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	hartrees
Energy at 0K	-147.902774
Energy at 298.15K	-147.905211
HF Energy	-147.902774
Nuclear repulsion energy	62.514098

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3338	3038	10.56
2	A₁	2302	2095	871.11
3	A₁	1561	1421	79.39
4	A₁	1283	1168	38.18
5	B₁	668	608	4.02
6	B₁	553	503	166.50
7	B₂	3473	3160	0.23
8	B₂	1236	1125	4.25
9	B₂	466	424	0.81

Atom	y (Å)	z (Å)
C1	0.000	-1.123
N2	0.000	0.161
N3	0.000	1.263
H4	0.945	-1.615
H5	-0.945	-1.615

	C1	N2	N3	H4	H5
C1		1.2838	2.3861	1.0658	1.0658
N2	1.2838		1.1023	2.0121	2.0121
N3	2.3861	1.1023		3.0298	3.0298
H4	1.0658	2.0121	3.0298		1.8905
H5	1.0658	2.0121	3.0298	1.8905

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	N3	180.000		N2	C1	H4	117.516
N2	C1	H5	117.516		H4	C1	H5	124.967

All results from a given calculation for CH₂NN (diazomethane)

using model chemistry: HF/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	-0.374
2	N	0.202
3	N	-0.104
4	H	0.138
5	H	0.138

	x	y	z	Total
	0.000	0.000	-1.277	1.277
CHELPG
AIM
ESP

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for CH2NN (diazomethane)

using model chemistry: HF/cc-pVTZ

States and conformations

All results from a given calculation for CH₂NN (diazomethane)