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	hartrees
Energy at 0K	-94.555914
Energy at 298.15K	-94.558829
HF Energy	-94.555914
Nuclear repulsion energy	32.785712

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'	3607	3607	24.79	78.02	0.70	0.82
2	A'	3460	3460	3.66	261.77	0.21	0.35
3	A'	2946	2946	99.51	158.12	0.46	0.63
4	A'	1691	1691	23.95	12.27	0.67	0.80
5	A'	1450	1450	17.02	12.01	0.17	0.29
6	A'	1385	1385	17.04	8.76	0.06	0.11
7	A'	1078	1078	20.99	7.65	0.22	0.37
8	A"	1146	1146	11.26	0.15	0.75	0.86
9	A"	805	805	152.20	0.15	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.788
N2	0.063	-0.525
H3	-1.008	1.098
H4	-0.761	-1.126
H5	0.947	-1.023

	C1	N2	H3	H4	H5
C1		1.3136	1.1152	2.0841	2.0149
N2	1.3136		1.9449	1.0197	1.0138
H3	1.1152	1.9449		2.2376	2.8840
H4	2.0841	1.0197	2.2376		1.7107
H5	2.0149	1.0138	2.8840	1.7107

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	126.087		C1	N2	H5	119.367
N2	C1	H3	106.117		H4	N2	H5	114.546

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: wB97X-D/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	0.046
2	N	0.214
3	H	-0.272
4	H	0.009
5	H	0.002

	x	y	z	Total
	-1.377	-3.265	0.000	3.544
CHELPG
AIM
ESP

	x	y	z
x	3.810	0.062	0.000
y	0.062	4.738	0.000
z	0.000	0.000	3.056

<r²>	20.070
(<r²>)^1/2	4.480

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: wB97X-D/daug-cc-pVDZ

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)