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	hartrees
Energy at 0K	-1398.221055
Energy at 298.15K
HF Energy	-1398.149430
Nuclear repulsion energy	224.816881

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'	438	438	0.00	12.00	0.13	0.23
2	A₂"	460	460	12.69	0.00	0.75	0.86
3	E'	885	885	342.93	0.00	0.75	0.86
3	E'	885	885	342.91	0.00	0.75	0.86
4	E'	263	263	1.59	7.09	0.75	0.86
4	E'	263	263	1.59	7.09	0.75	0.86

Atom	x (Å)	y (Å)
B1	0.000	0.000
Cl2	0.000	1.778
Cl3	1.540	-0.889
Cl4	-1.540	-0.889

	B1	Cl2	Cl3	Cl4
B1		1.7785	1.7785	1.7785
Cl2	1.7785		3.0804	3.0804
Cl3	1.7785	3.0804		3.0804
Cl4	1.7785	3.0804	3.0804

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Cl2	B1	Cl3	120.000		Cl2	B1	Cl4	120.000
Cl3	B1	Cl4	120.000

All results from a given calculation for BCl₃ (Borane, trichloro-)

using model chemistry: B2PLYP=FULLultrafine/3-21G

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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All results from a given calculation for BCl3 (Borane, trichloro-)

using model chemistry: B2PLYP=FULLultrafine/3-21G

States and conformations

All results from a given calculation for BCl₃ (Borane, trichloro-)