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	hartrees
Energy at 0K	-94.580314
Energy at 298.15K	-94.583207
HF Energy	-94.580314
Nuclear repulsion energy	32.677235

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'	3412	3400	12.80	103.52	0.66	0.80
2	A'	3207	3196	71.19	703.33	0.30	0.46
3	A'	2835	2826	103.63	209.86	0.62	0.76
4	A'	1640	1635	6.43	32.58	0.55	0.71
5	A'	1392	1388	13.60	14.21	0.10	0.18
6	A'	1335	1330	8.52	31.00	0.26	0.42
7	A'	1044	1040	29.72	27.86	0.28	0.44
8	A"	1127	1123	10.18	0.20	0.75	0.86
9	A"	783	781	132.95	1.04	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.790
N2	0.063	-0.525
H3	-1.004	1.107
H4	-0.762	-1.144
H5	0.950	-1.028

	C1	N2	H3	H4	H5
C1		1.3157	1.1124	2.1027	2.0235
N2	1.3157		1.9497	1.0306	1.0197
H3	1.1124	1.9497		2.2640	2.8940
H4	2.1027	1.0306	2.2640		1.7153
H5	2.0235	1.0197	2.8940	1.7153

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	126.893		C1	N2	H5	119.550
N2	C1	H3	106.533		H4	N2	H5	113.558

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: BLYP/aug-cc-pVTZ

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	-0.480
2	N	-0.027
3	H	0.264
4	H	0.095
5	H	0.149

	x	y	z	Total
	-1.272	-3.189	0.000	3.433
CHELPG
AIM
ESP

	x	y	z
x	4.133	0.279	0.000
y	0.279	5.400	0.000
z	0.000	0.000	3.154

<r²>	20.359
(<r²>)^1/2	4.512

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: BLYP/aug-cc-pVTZ

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)