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	hartrees
Energy at 0K	-82.017951
Energy at 298.15K	-82.022205
HF Energy	-82.017951
Nuclear repulsion energy	32.201205

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	3623	3472	22.48	114.77	0.11	0.20
2	A₁	2588	2480	99.12	130.37	0.10	0.19
3	A₁	1626	1558	65.53	5.96	0.75	0.86
4	A₁	1364	1307	42.38	7.98	0.07	0.13
5	A₁	1149	1101	0.00	12.17	0.55	0.71
6	A₂	867	831	0.00	1.41	0.75	0.86
7	B₁	1004	962	22.25	0.94	0.75	0.86
8	B₁	598	573	172.99	0.05	0.75	0.86
9	B₂	3725	3570	29.35	67.93	0.75	0.86
10	B₂	2669	2557	170.00	43.21	0.75	0.86
11	B₂	1128	1081	31.74	1.12	0.75	0.86
12	B₂	742	711	0.06	0.01	0.75	0.86

Atom	y (Å)	z (Å)
B1	0.000	-0.776
N2	0.000	0.610
H3	1.055	-1.361
H4	-1.055	-1.361
H5	0.845	1.165
H6	-0.845	1.165

	B1	N2	H3	H4	H5	H6
B1		1.3866	1.2065	1.2065	2.1173	2.1173
N2	1.3866		2.2361	2.2361	1.0107	1.0107
H3	1.2065	2.2361		2.1107	2.5351	3.1611
H4	1.2065	2.2361	2.1107		3.1611	2.5351
H5	2.1173	1.0107	2.5351	3.1611		1.6897
H6	2.1173	1.0107	3.1611	2.5351	1.6897

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	N2	H5	123.296	B1	N2	H6	123.296
N2	B1	H3	118.993	N2	B1	H4	118.993
H3	B1	H4	122.014	H5	N2	H6	113.409

All results from a given calculation for BH₂NH₂ (Boranamine)

using model chemistry: mPW1PW91/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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Number	Element	Mulliken
1	B	-0.105
2	N	-0.001
3	H	-0.048
4	H	-0.048
5	H	0.101
6	H	0.101

	x	y	z	Total
	0.000	0.000	2.172	2.172
CHELPG
AIM
ESP

<r²>	24.127
(<r²>)^1/2	4.912

All results from a given calculation for BH2NH2 (Boranamine)

using model chemistry: mPW1PW91/cc-pVDZ

States and conformations

All results from a given calculation for BH₂NH₂ (Boranamine)