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	hartrees
Energy at 0K	-684.770648
Energy at 298.15K
HF Energy	-684.770648
Nuclear repulsion energy	137.145696

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	1140	1131	404.44	0.95	0.28	0.43
2	A₁	626	621	34.19	6.72	0.11	0.19
3	A₁	389	386	5.82	2.66	0.56	0.72
4	B₁	540	536	49.07	2.71	0.75	0.86
5	B₂	1347	1337	264.06	0.01	0.75	0.86
6	B₂	323	321	4.98	3.82	0.75	0.86

Atom	y (Å)	z (Å)
B1	0.000	-0.452
Cl2	0.000	1.345
F3	1.172	-1.145
F4	-1.172	-1.145

	B1	Cl2	F3	F4
B1		1.7969	1.3614	1.3614
Cl2	1.7969		2.7522	2.7522
F3	1.3614	2.7522		2.3430
F4	1.3614	2.7522	2.3430

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Cl2	B1	F3	120.622		Cl2	B1	F4	120.622
F3	B1	F4	118.755

All results from a given calculation for BClF₂ (Chlorodifluoroborane)

using model chemistry: BLYP/6-31G

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Number	Element	Mulliken
1	B	0.516
2	Cl	-0.061
3	F	-0.227
4	F	-0.227

	x	y	z	Total
	0.000	0.000	-0.023	0.023
CHELPG
AIM
ESP

<r²>	98.036
(<r²>)^1/2	9.901

All results from a given calculation for BClF2 (Chlorodifluoroborane)

using model chemistry: BLYP/6-31G

States and conformations

All results from a given calculation for BClF₂ (Chlorodifluoroborane)