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	hartrees
Energy at 0K	-82.003666
Energy at 298.15K	-82.007938
HF Energy	-82.003666
Nuclear repulsion energy	32.356443

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	3631	3481	15.44	110.84	0.14	0.24
2	A₁	2572	2466	102.03	119.97	0.12	0.22
3	A₁	1694	1623	80.49	4.19	0.74	0.85
4	A₁	1370	1313	50.27	5.93	0.03	0.05
5	A₁	1153	1105	0.04	13.43	0.53	0.70
6	A₂	881	845	0.00	2.08	0.75	0.86
7	B₁	999	957	32.53	2.02	0.75	0.86
8	B₁	624	598	236.71	0.00	0.75	0.86
9	B₂	3729	3575	18.34	64.79	0.75	0.86
10	B₂	2651	2541	180.82	46.60	0.75	0.86
11	B₂	1146	1099	42.23	0.97	0.75	0.86
12	B₂	747	716	0.04	0.00	0.75	0.86

Atom	y (Å)	z (Å)
B1	0.000	-0.775
N2	0.000	0.609
H3	1.046	-1.352
H4	-1.046	-1.352
H5	0.841	1.158
H6	-0.841	1.158

	B1	N2	H3	H4	H5	H6
B1		1.3833	1.1953	1.1953	2.1081	2.1081
N2	1.3833		2.2227	2.2227	1.0048	1.0048
H3	1.1953	2.2227		2.0929	2.5191	3.1411
H4	1.1953	2.2227	2.0929		3.1411	2.5191
H5	2.1081	1.0048	2.5191	3.1411		1.6823
H6	2.1081	1.0048	3.1411	2.5191	1.6823

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	N2	H5	123.167	B1	N2	H6	123.167
N2	B1	H3	118.898	N2	B1	H4	118.898
H3	B1	H4	122.204	H5	N2	H6	113.666

All results from a given calculation for BH₂NH₂ (Boranamine)

using model chemistry: B1B95/6-311G*

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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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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Number	Element	Mulliken
1	B	0.044
2	N	-0.761
3	H	0.011
4	H	0.011
5	H	0.347
6	H	0.347

	x	y	z	Total
	0.000	0.000	2.171	2.171
CHELPG
AIM
ESP

<r²>	24.092
(<r²>)^1/2	4.908

All results from a given calculation for BH2NH2 (Boranamine)

using model chemistry: B1B95/6-311G*

States and conformations

All results from a given calculation for BH₂NH₂ (Boranamine)