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	hartrees
Energy at 0K	-94.507952
Energy at 298.15K	-94.510904
HF Energy	-94.507952
Nuclear repulsion energy	32.572286

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'	3626	3432	11.89	103.52	0.57	0.72
2	A'	3423	3240	26.34	337.99	0.29	0.45
3	A'	2879	2725	155.87	143.89	0.48	0.65
4	A'	1771	1676	10.66	34.33	0.41	0.58
5	A'	1457	1379	31.54	10.60	0.70	0.83
6	A'	1392	1317	21.33	3.21	0.34	0.51
7	A'	1097	1038	30.67	15.06	0.59	0.75
8	A"	1159	1097	14.53	1.12	0.75	0.86
9	A"	946	895	287.01	1.06	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.062	0.796
N2	0.062	-0.531
H3	-1.011	1.113
H4	-0.745	-1.155
H5	0.948	-1.018

	C1	N2	H3	H4	H5
C1		1.3268	1.1189	2.1113	2.0187
N2	1.3268		1.9628	1.0206	1.0109
H3	1.1189	1.9628		2.2828	2.8943
H4	2.1113	1.0206	2.2828		1.6989
H5	2.0187	1.0109	2.8943	1.6989

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	127.689		C1	N2	H5	118.810
N2	C1	H3	106.435		H4	N2	H5	113.501

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: mPW1PW91/6-31G

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	-0.049
2	N	-0.723
3	H	0.088
4	H	0.324
5	H	0.361

	x	y	z	Total
	-1.338	-3.230	0.000	3.496
CHELPG
AIM
ESP

	x	y	z
x	2.686	-0.241	0.000
y	-0.241	3.728	0.000
z	0.000	0.000	1.338

<r²>	19.925
(<r²>)^1/2	4.464

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: mPW1PW91/6-31G

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)