Zeitschrift für Kristallographie - New Crystal Structures最新文献

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The crystal structure of (Z)-4-ethyl-2-((4-ethyl-3,5-dimethyl-1H-pyrrol-2-yl)methylene)-3,5-dimethyl-2H-pyrrol-1-ium 2,2'-spirobi[naphtho[1,8-de][1,3,2]dioxaborinin]-2-uide, C37H37BN2O4 The crystal structure of (Z)-4-ethyl-2-((4-ethyl-3,5-dimethyl-1H-pyrrol-2-yl)methylene)-3,5-dimethyl-2H-pyrrol-1-ium 2,2'-spirobi[naphtho[1,8-de][1,3,2]dioxaborinin]-2-uide, C37H37BN2O4

Zeitschrift für Kristallographie - New Crystal Structures

Pub Date : 2024-04-04 DOI: 10.1515/ncrs-2024-0063

A. Alsuhaibani, Yazeed M. Asiri, Moamen S. Refat, Rabia Usman, Arshad Khan

C37H37BN2O4, monoclinic, I2/a (no. 15), a = 13.8030(3) Å, b = 17.6109(2) Å, c = 14.1059(3) Å, β = 117.524(3)°, V = 3040.83(11) Å3, Z = 4, Rgt (F) = 0.0340, wRref (F 2) = 0.0867, T = 150 K.

C37H37BN2O4，单斜，I2/a（编号 15），a = 13.8030(3)埃，b = 17.6109(2)埃，c = 14.1059(3)埃，β = 117.524(3)°，V = 3040.83(11)埃3，Z = 4，Rgt (F) = 0.0340，wRref (F 2) = 0.0867，T = 150 K。

引用次数: 0

The crystal structure of 1-(4-carboxybutyl)-3-methyl-1H-imidazol-3-ium hexafluoridophosphate, C9H15F6N2O2P 1-(4-羧基丁基)-3-甲基-1H-咪唑-3-鎓六氟磷酸盐（C9H15F6N2O2P）的晶体结构

Zeitschrift für Kristallographie - New Crystal Structures

Pub Date : 2024-04-04 DOI: 10.1515/ncrs-2024-0096

Zhiwei Mao, Kehua Zhang, Lian Zhou, Wensheng Zou

C9H15F6N2O2P, triclinic, P1̄ (no. 2), a = 8.678(8) Å, b = 9.085(9) Å, c = 10.279(8) Å, α = 84.23(2)∘, β = 79.02(2)∘, γ = 62.103(14)∘, V = 62.10(1) Å3, Z = 2, Rgt (F) = 0.0730, wRref (F 2) = 0.1663, T = 296 K.

C9H15F6N2O2P, 三菱形, P1̄ (no. 2), a = 8.678(8) Å, b = 9.085(9) Å, c = 10.279(8) Å, α = 84.23(2)∘, β = 79.02(2)∘, γ = 62.103(14)∘, V = 62.10(1) Å3, Z = 2, Rgt (F) = 0.0730, wRref (F 2) = 0.1663, T = 296 K.

引用次数: 0

The crystal structure of NdB6O8(OH)5·H3BO3 NdB6O8(OH)5-H3BO3 的晶体结构

Zeitschrift für Kristallographie - New Crystal Structures

Pub Date : 2024-04-04 DOI: 10.1515/ncrs-2024-0075

Tobias A. Teichtmeister, Alexander Hugo Bernhart, H. Huppertz

NdB6O8(OH)5·H3BO3, triclinic, P 1 ‾

$overline{1}$

(no. 2), a = 6.8304(7) Å, b = 7.2004(5) Å, c = 12.707(2) Å, α = 95.479(5)°, β = 98.652(6)°, γ = 101.758(5)°, V = 599.7(2) Å3, Z = 2, R gt(F) = 0.0378, wR ref(F 2) = 0.0826, T = 289(1) K.

NdB6O8(OH)5-H3BO3，三菱形，P 1 ‾ $overline{1}$（no.2), a = 6.8304(7) Å, b = 7.2004(5) Å, c = 12.707(2) Å, α = 95.479(5)°, β = 98.652(6)°, γ = 101.758(5)°, V = 599.7(2) Å3, Z = 2, R gt(F) = 0.0378, wR ref(F 2) = 0.0826, T = 289(1) K。

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引用次数: 0

Crystal structure of bis(methylammonium) hexadecaselenidopalladate(II), (CH3NH3)2PdSe16 双（甲基铵）十六硒钯酸盐（II），(CH3NH3)2PdSe16 的晶体结构

Zeitschrift für Kristallographie - New Crystal Structures

Pub Date : 2024-04-04 DOI: 10.1515/ncrs-2024-0064

Kang-Woo Kim, Jong-Min Noh

(CH3NH3)2PdSe16, tetragonal, P 4 ‾ b 2

$Poverline{4}bmathrm{2}$

(no. 117), a = 12.7821(4) Å, c = 7.1123(2) Å, V = 1162.02(8) Å3, Z = 2, R gt(F) = 0.0306, wR ref(F 2) = 0.0841, T = 223 K.

(CH3NH3)2PdSe16, 正四面体, P 4 ‾ b 2 $Poverline{4}bmathrm{2}$ (no. 117), a = 12.7821(4) Å, c = 7.1123(2) Å, V = 1162.02(8) Å3, Z = 2, R gt(F) = 0.0306, wR ref(F 2) = 0.0841, T = 223 K.

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引用次数: 0

The crystal structure of Tb3B5O11(OH)2 Tb3B5O11(OH)2 的晶体结构

Zeitschrift für Kristallographie - New Crystal Structures

Pub Date : 2024-04-04 DOI: 10.1515/ncrs-2024-0062

Tobias A. Teichtmeister, H. Huppertz

Tb3B5O11(OH)2, orthorhombic, Pnna (no. 52), a = 4.4471(1) Å, b = 13.0934(4) Å, c = 13.9055(3) Å, V = 809.68(4) Å3, Z = 4, R gt(F) = 0.0260, wR ref(F 2) = 0.0556, T = 301(1) K.

Tb3B5O11(OH)2，正交，Pnna（编号 52），a = 4.4471(1)埃，b = 13.0934(4)埃，c = 13.9055(3)埃，V = 809.68(4)埃3，Z = 4，R gt(F) = 0.0260，wR ref(F 2) = 0.0556，T = 301(1) K。

引用次数: 0

Crystal structure of poly[μ10-4,4′-methylene-bis(oxy)benzoatodipotassium], C15H10K2O6 聚[μ10-4,4′-亚甲基双（氧）苯甲酸二钾]（C15H10K2O6）的晶体结构

Zeitschrift für Kristallographie - New Crystal Structures

Pub Date : 2024-04-04 DOI: 10.1515/ncrs-2024-0043

Ting-Ting Wu, Si-Na Gu, Zhi-Ying Ou, Ting Y. Nie, Yang Liu

C15H10K2O6, orthorhombic, Pna21 (no. 33), a = 11.4410(13) Å, b = 3.9881(5) Å, c = 32.465(4) Å, V = 1481.3(3) Å3, Z = 4, R gt(F) = 0.0356, wR ref(F 2) = 0.0918, T = 296.15 K.

C15H10K2O6，正菱形，Pna21（编号 33），a = 11.4410(13) Å，b = 3.9881(5) Å，c = 32.465(4) Å，V = 1481.3(3) Å3，Z = 4，R gt(F) = 0.0356，wR ref(F 2) = 0.0918，T = 296.15 K。

引用次数: 0

Synthesis and crystal structure of methyl 2-{[4-(4-cyclopropyl-1-naphthyl)-4H-1,2,4-triazole-3-yl]thio} acetate, C18H17N3O2S 2-{[4-(4-环丙基-1-萘基)-4H-1,2,4-三唑-3-基]硫}乙酸甲酯 C18H17N3O2S 的合成与晶体结构

Zeitschrift für Kristallographie - New Crystal Structures

Pub Date : 2024-04-04 DOI: 10.1515/ncrs-2024-0056

Xian-Zhu Yuan, Ding-Wa Zhang, Xiu-Guang Yi, Zeng Hui-lei, Zhi-Qiang Yi

C18H17N3O2S, monoclinic, P21/c (no. 14), a = 10.9713(5) Å, b = 15.4445(8) Å, c = 9.8221(4) Å, β = 98.275(4)°, V = 1646.99(13) Å3, Z = 4, Rgt (F) = 0.0401, wRref (F 2) = 0.0990, T = 296(2) K.

C18H17N3O2S，单斜，P21/c（编号 14），a = 10.9713(5)埃，b = 15.4445(8)埃，c = 9.8221(4)埃，β = 98.275(4)°，V = 1646.99(13)埃3，Z = 4，Rgt (F) = 0.0401，wRref (F 2) = 0.0990，T = 296(2) K。

引用次数: 0

Single-crystal structure determination of Tm3B12O19(OH)7 Tm3B12O19(OH)7 的单晶结构测定

Zeitschrift für Kristallographie - New Crystal Structures

Pub Date : 2024-04-03 DOI: 10.1515/ncrs-2024-0073

Tobias A. Teichtmeister, H. Huppertz

Tm3B12O19(OH)7, monoclinic, C2 (no. 5), a = 23.9849(5) Å, b = 4.4400(1) Å, c = 7.0771(1) Å, β = 94.698(1)°, V = 751.13(3) Å3, Z = 2, R gt(F) = 0.0106, wR ref(F 2) = 0.0247, T = 298(1) K.

Tm3B12O19(OH)7，单斜，C2（5 号），a = 23.9849(5)埃，b = 4.4400(1)埃，c = 7.0771(1)埃，β = 94.698(1)°，V = 751.13(3)埃3，Z = 2，R gt(F) = 0.0106，wR ref(F 2) = 0.0247，T = 298(1) K。

引用次数: 0

The crystal structure of N′-{5-[2-(2,6-dimethylphenoxy) acetamido]-4-hydroxy-1,6-diphenylhexan-2-yl}-3-methyl-2-(2-oxo-1,3-diazinan-1-yl)butanamide hydrate N′-{5-[2-(2,6-二甲基苯氧基)乙酰氨基]-4-羟基-1,6-二苯基己-2-基}-3-甲基-2-(2-氧代-1,3-二氮杂环丁-1-基)丁酰胺水合物的晶体结构

Zeitschrift für Kristallographie - New Crystal Structures

Pub Date : 2024-03-29 DOI: 10.1515/ncrs-2024-0011

Tebogo M. L. Mokoto, A. Lemmerer, Yasin Sayed, Mark G. Smith

2(C37H47N4O5·3(H2O), triclinic, P1 (no. 1), a = 11.6319(7) Å, b = 13.9452(7) Å, c = 24.1727(14) Å, α = 106.203°, β = 103.296°, γ = 90.777°, V = 3651.7(4) Å3, Z = 4, R gt(F) = 0.0682, wR ref(F 2) = 0.1899, T = 123 K.

2(C37H47N4O5-3(H2O)，三菱形，P1（1 号），a = 11.6319(7)埃，b = 13.9452(7)埃，c = 24.1727(14)埃，α = 106.203°, β = 103.296°, γ = 90.777°, V = 3651.7(4) Å3, Z = 4, R gt(F) = 0.0682, wR ref(F 2) = 0.1899, T = 123 K.

引用次数: 0

Crystal structure of (E)-3-(dimethylamino)-1-(2-hydroxy-4,6-dimethoxyphenyl)prop-2-en-1-one, C13H17NO4 (E)-3-(二甲基氨基)-1-(2-羟基-4,6-二甲氧基苯基)丙-2-烯-1-酮，C13H17NO4 的晶体结构

Zeitschrift für Kristallographie - New Crystal Structures

Pub Date : 2024-03-28 DOI: 10.1515/ncrs-2024-0018

Chun-Bo Liang, Wei-Zhong Li, Lian-Hua Xu, Hua-Bin Wang

C13H17NO4, monoclinic, Cc (no. 9), a = 11.6900(4) Å, b = 8.4868(2) Å, c = 14.1607(5) Å, β = 112.549(4)°, V = 1297.49(8) Å3, Z = 4, R gt(F) = 0.0373, wR ref(F 2) = 0.1071, T = 295.5 K.

C13H17NO4，单斜，Cc（9 号），a = 11.6900(4)埃，b = 8.4868(2)埃，c = 14.1607(5)埃，β = 112.549(4)°，V = 1297.49(8)埃3，Z = 4，R gt(F) = 0.0373，wR ref(F 2) = 0.1071，T = 295.5 K。

引用次数: 0

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