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	hartrees
Energy at 0K	-94.486259
Energy at 298.15K	-94.489211
HF Energy	-94.486259
Nuclear repulsion energy	32.594783

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'	3619	3452	11.43	105.94	0.56	0.72
2	A'	3415	3257	26.90	340.15	0.29	0.45
3	A'	2870	2737	156.85	141.48	0.48	0.65
4	A'	1767	1685	10.41	35.04	0.41	0.58
5	A'	1455	1387	30.73	10.65	0.70	0.82
6	A'	1390	1326	21.86	3.14	0.38	0.55
7	A'	1094	1043	29.57	15.38	0.59	0.74
8	A"	1158	1104	13.96	1.14	0.75	0.86
9	A"	950	906	281.73	1.20	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.062	0.796
N2	0.062	-0.530
H3	-1.012	1.109
H4	-0.744	-1.155
H5	0.948	-1.017

	C1	N2	H3	H4	H5
C1		1.3257	1.1188	2.1106	2.0174
N2	1.3257		1.9595	1.0202	1.0106
H3	1.1188	1.9595		2.2793	2.8913
H4	2.1106	1.0202	2.2793		1.6977
H5	2.0174	1.0106	2.8913	1.6977

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	127.755		C1	N2	H5	118.809
N2	C1	H3	106.258		H4	N2	H5	113.436

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: B1B95/6-31G

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	-0.043
2	N	-0.709
3	H	0.079
4	H	0.317
5	H	0.355

	x	y	z	Total
	-1.307	-3.233	0.000	3.487
CHELPG
AIM
ESP

	x	y	z
x	2.698	-0.240	0.000
y	-0.240	3.729	0.000
z	0.000	0.000	1.328

<r²>	19.901
(<r²>)^1/2	4.461

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: B1B95/6-31G

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)