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	hartrees
Energy at 0K	-94.500976
Energy at 298.15K	-94.503893
HF Energy	-94.398333
Nuclear repulsion energy	32.820996

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'	3593	3593	18.89	85.44	0.64	0.78
2	A'	3427	3427	9.08	263.70	0.27	0.43
3	A'	2937	2937	122.50	159.70	0.47	0.64
4	A'	1707	1707	13.09	18.53	0.46	0.63
5	A'	1441	1441	16.91	10.17	0.44	0.62
6	A'	1408	1408	12.44	2.74	0.20	0.33
7	A'	1081	1081	22.84	8.20	0.52	0.69
8	A"	1175	1175	12.31	1.00	0.75	0.86
9	A"	806	806	171.77	0.63	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.790
N2	0.063	-0.525
H3	-1.005	1.086
H4	-0.756	-1.132
H5	0.945	-1.020

	C1	N2	H3	H4	H5
C1		1.3141	1.1082	2.0886	2.0129
N2	1.3141		1.9326	1.0192	1.0116
H3	1.1082	1.9326		2.2324	2.8701
H4	2.0886	1.0192	2.2324		1.7041
H5	2.0129	1.0116	2.8701	1.7041

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	126.591		C1	N2	H5	119.312
N2	C1	H3	105.532		H4	N2	H5	114.097

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: B2PLYP/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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Number	Element	Mulliken
1	C	-0.170
2	N	-0.321
3	H	0.060
4	H	0.200
5	H	0.231

	x	y	z	Total
	-1.287	-3.235	0.000	3.481
CHELPG
AIM
ESP

	x	y	z
x	2.917	-0.174	0.000
y	-0.174	3.910	-0.000
z	0.000	-0.000	1.787

<r²>	19.833
(<r²>)^1/2	4.453

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: B2PLYP/6-311G**

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)