Barriers to internal rotation of CH3 groups in solid Au2I2(CH3)4 from infra-red band shape measurements

R.C. Leech, D.B. Powell, N. Sheppard
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引用次数: 13

Abstract

The band shape of the asymmetric CH3 deformation vibration in the infra-red spectrum of Au2I2(CH3)4 has been studied as a Cs I disk at temperatures from 90°K to 298°K. The barrier to internal rotation in the solid state has been calculated by two methods based on those of Bulanin and Orlova, and of Rakov. A mean value of the barrier is estimated as 270 ± 70 cm.−1.

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固体Au2I2(CH3)4中CH3基团内旋障碍的红外波段形状测量
研究了Au2I2(CH3)4在90 ~ 298°K温度下的非对称CH3变形振动的红外光谱带形。在Bulanin和Orlova以及Rakov的基础上,用两种方法计算了固态内旋势垒。该屏障的平均值估计为270±70厘米。
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