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	hartrees
Energy at 0K	-94.532622
Energy at 298.15K	-94.535544
HF Energy	-94.532622
Nuclear repulsion energy	32.876858

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'	3616	3459	28.73	68.47	0.70	0.82
2	A'	3446	3296	8.15	295.15	0.25	0.41
3	A'	2954	2826	113.76	146.34	0.62	0.76
4	A'	1712	1638	15.45	19.81	0.63	0.77
5	A'	1461	1397	19.69	12.33	0.31	0.48
6	A'	1399	1339	37.57	3.94	0.40	0.58
7	A'	1082	1035	22.73	6.71	0.58	0.73
8	A"	1162	1112	11.51	1.02	0.75	0.86
9	A"	833	797	185.42	0.14	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.062	0.788
N2	0.062	-0.523
H3	-1.005	1.084
H4	-0.752	-1.135
H5	0.945	-1.016

	C1	N2	H3	H4	H5
C1		1.3105	1.1082	2.0884	2.0086
N2	1.3105		1.9290	1.0189	1.0114
H3	1.1082	1.9290		2.2337	2.8663
H4	2.0884	1.0189	2.2337		1.7009
H5	2.0086	1.0114	2.8663	1.7009

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	126.972		C1	N2	H5	119.223
N2	C1	H3	105.491		H4	N2	H5	113.804

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: B1B95/6-31+G**

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	-0.200
2	N	-0.499
3	H	0.082
4	H	0.290
5	H	0.328

	x	y	z	Total
	-1.470	-3.383	0.000	3.688
CHELPG
AIM
ESP

	x	y	z
x	3.240	0.020	0.000
y	0.020	4.443	0.000
z	0.000	0.000	2.361

<r²>	20.020
(<r²>)^1/2	4.474

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: B1B95/6-31+G**

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)