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Infrared Spectra of Crystalline Cyclopentane and Cyclopentane-d10

Journal Article · · Journal of Chemical Physics
DOI:https://doi.org/10.1063/1.1671944· OSTI ID:4725224

Infrared spectra of crystalline cyclopentane and cyclopentane-d10 have been measured at different temperatures between 4000 and 200 cm-1. Spectroscopic evidence shows that form I (–120°C) and form II (–140°C) have the same degree of disorder as the liquid. In the ordered crystal form III (–180°C) the molecule has a rigid bent conformation. By the mixed-crystal technique the nature of the observed splittings has been established. This has permitted us to show that the site symmetry of the molecule in form III is $$C_1$$, and packing concepts together with the spectroscopic data led to the choice of $$C^5_{2h}$$ as the possible space group of the lowest-temperature form.

Research Organization:
Universita di Firenze, (Italy). Laboratorio di Spettroscopia Molecolare
Sponsoring Organization:
US Atomic Energy Commission (AEC); Italian Consiglio Nazionale delle Ricerche
NSA Number:
NSA-24-009295
OSTI ID:
4725224
Journal Information:
Journal of Chemical Physics, Journal Name: Journal of Chemical Physics Journal Issue: 12 Vol. 51; ISSN 0021-9606
Publisher:
American Institute of Physics (AIP)Copyright Statement
Country of Publication:
Italy
Language:
English

References (11)

A normal coordinate analysis of cyclopentane journal January 1957
The pure rotational Raman spectrum of cyclopentane-d0 and cyclopentane-d10 journal January 1963
Cyclopentane: Molecular vibrational analysis journal July 1966
X-Ray Investigation of Crystalline Cyclopentane and Neohexane1 journal November 1951
The Thermodynamics and Molecular Structure of Cyclopentane 1 journal October 1947
The Heat Capacity and Entropy, Heats of Transition, Fusion and Vaporization and the Vapor Pressures of Cyclopentane. Evidence for a Non-planar Structure journal March 1943
Conformations and Strain Energy of Cyclopentane and its Derivatives journal July 1959
Consistent Force Field for Calculations of Conformations, Vibrational Spectra, and Enthalpies of Cycloalkane and n ‐Alkane Molecules journal December 1968
Vibrational Spectra and Structure of Small‐Ring Compounds. X. Spectroscopic Evidence for Pseudorotation in Cyclopentane journal September 1968
The Infra-Red and Raman Spectra of Cyclopentane, Cyclopentane-d1, and Cyclopentane-d10 journal December 1950
The crystal and molecular structure of cyclopentadiene journal August 1965

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