CCCBDB listing of experimental data page 2

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Property	Value	Uncertainty	units	Reference
Hfg(298.15K)	55.00	3.40	kJ mol^-1	2005Lag/Ker:1802-1809
Hfg(0K)	70.40	3.40	kJ mol^-1	2005Lag/Ker:1802-1809
Integrated Heat Capacity (0 to 298.15K)	12.98		kJ mol^-1	2005Lag/Ker:1802-1809

Bond Type	Count
H-C	2
C-Br	1
C-I	1

Atom 1	Atom 2
C1	Br2
C1	I3
C1	H4
C1	H5

State	Config	State description	Conf description	Exp. min.	Dipole (Debye)				Reference	comment	Point Group	Components
State	Config	State description	Conf description	Exp. min.	x	y	z	total	Reference	comment	Point Group	dipole	quadrupole
1	1	¹A^'	C_s	True							C_s	2	3

State	Config	State description	Conf description	Exp. min.	Quadrupole (D Å)			Reference	comment	Point Group	Components
State	Config	State description	Conf description	Exp. min.	xx	yy	zz	Reference	comment	Point Group	dipole	quadrupole
1	1	¹A^'	C_s	True						C_s	2	3

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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squib	reference	DOI
2005Lag/Ker:1802-1809	AF Lago, JP Kercher, A Bodi, B Sztaray, B Miller, D Wurzelmann, T Baer "Dissociative Photoionization and Thermochemistry of Dihalomethane Compounds Studied by Threshold Photoelectron Photoion Coincidence Spectroscopy" J. Phys. Chem. A 2005, 109, 1802-1809	10.1021/jp045337s
2014Bai/Duf:11744-11750	S Bailleux, D Duflot, K Taniguchi, S Sakai, H Ozeki, T Okabayashi, W C Bailey "Fourier Transform Microwave and Millimeter-Wave Spectroscopy of Bromoiodomethane, CH2BrI" J. Phys. Chem. A 2014, 118, 50, 11744–11750	10.1021/jp510119e

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Experimental data for CH2BrI (bromoiodomethane)

Experimental data for CH₂BrI (bromoiodomethane)