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	hartrees
Energy at 0K	-94.480695
Energy at 298.15K	-94.483610
HF Energy	-94.480695
Nuclear repulsion energy	32.816375

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3582	3582	22.59	95.06	0.70	0.82
2	A'	3418	3418	14.32	382.16	0.24	0.39
3	A'	2946	2946	100.90	175.41	0.49	0.65
4	A'	1684	1684	17.70	17.94	0.62	0.76
5	A'	1455	1455	12.30	10.30	0.20	0.34
6	A'	1374	1374	15.60	13.65	0.10	0.18
7	A'	1068	1068	23.81	12.76	0.23	0.38
8	A"	1149	1149	10.68	0.22	0.75	0.86
9	A"	810	810	146.55	0.36	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.787
N2	0.063	-0.524
H3	-1.008	1.098
H4	-0.759	-1.129
H5	0.947	-1.021

	C1	N2	H3	H4	H5
C1		1.3107	1.1157	2.0853	2.0126
N2	1.3107		1.9442	1.0214	1.0142
H3	1.1157	1.9442		2.2417	2.8837
H4	2.0853	1.0214	2.2417		1.7099
H5	2.0126	1.0142	2.8837	1.7099

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	126.358		C1	N2	H5	119.366
N2	C1	H3	106.223		H4	N2	H5	114.276

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: HSEh1PBE/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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Number	Element	Mulliken
1	C	0.015
2	N	0.229
3	H	-0.254
4	H	0.024
5	H	-0.014

	x	y	z	Total
	-1.325	-3.231	0.000	3.492
CHELPG
AIM
ESP

	x	y	z
x	3.863	0.105	0.000
y	0.105	4.875	0.000
z	0.000	0.000	3.015

<r²>	20.075
(<r²>)^1/2	4.481

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: HSEh1PBE/daug-cc-pVDZ

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)