Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for CHFCHClz ((Z)-1-Chloro-2-fluoroethene)

using model chemistry: CCSD(T)/6-311+G(3df,2p)

States and conformations

Geometric Data calculated at CCSD(T)/6-311+G(3df,2p)

Point Group is C_s

Cartesians (Å)

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.866	0.000
C2	1.253	0.415	0.000
Cl3	-1.378	-0.161	0.000
F4	1.554	-0.884	0.000
H5	-0.192	1.929	0.000
H6	2.117	1.066	0.000

Atom - Atom Distances (Å)

	C1	C2	Cl3	F4	H5	H6
C1		1.3318	1.7187	2.3402	1.0804	2.1268
C2	1.3318		2.6934	1.3330	2.0934	1.0822
Cl3	1.7187	2.6934		3.0199	2.4031	3.7046
F4	2.3402	1.3330	3.0199		3.3109	2.0294
H5	1.0804	2.0934	2.4031	3.3109		2.4658
H6	2.1268	1.0822	3.7046	2.0294	2.4658

More geometry information
Calculated Bond Angles

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	F4	122.857		C1	C2	H6	123.207
C2	C1	Cl3	123.500		C2	C1	H5	120.061
Cl3	C1	H5	116.439		F4	C2	H6	113.936