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	hartrees
Energy at 0K	-1405.151295
Energy at 298.15K	-1405.151503
HF Energy	-1404.969725
Nuclear repulsion energy	227.860492

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'	471	471	0.00	13.20	0.03	0.07
2	A₂"	452	452	5.45	0.00	0.75	0.86
3	E'	955	955	352.11	1.01	0.75	0.86
3	E'	955	955	352.15	1.01	0.75	0.86
4	E'	254	254	0.81	1.45	0.75	0.86
4	E'	254	254	0.81	1.45	0.75	0.86

Atom	x (Å)	y (Å)
B1	0.000	0.000
Cl2	0.000	1.755
Cl3	1.520	-0.877
Cl4	-1.520	-0.877

	B1	Cl2	Cl3	Cl4
B1		1.7547	1.7547	1.7547
Cl2	1.7547		3.0392	3.0392
Cl3	1.7547	3.0392		3.0392
Cl4	1.7547	3.0392	3.0392

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=FULL/daug-cc-pVDZ

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=FULL/daug-cc-pVDZ

States and conformations

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