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	hartrees
Energy at 0K	-148.750393
Energy at 298.15K	-148.752639
HF Energy	-148.750393
Nuclear repulsion energy	61.074547

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3203	3088	15.43
2	A₁	2204	2125	429.48
3	A₁	1445	1393	35.67
4	A₁	1217	1174	2.80
5	B₁	568	548	14.49
6	B₁	462	445	153.87
7	B₂	3326	3207	2.37
8	B₂	1117	1077	1.85
9	B₂	424	409	0.18

Atom	y (Å)	z (Å)
C1	0.000	-1.143
N2	0.000	0.153
N3	0.000	1.298
H4	0.954	-1.650
H5	-0.954	-1.650

	C1	N2	N3	H4	H5
C1		1.2960	2.4413	1.0800	1.0800
N2	1.2960		1.1452	2.0397	2.0397
N3	2.4413	1.1452		3.0987	3.0987
H4	1.0800	2.0397	3.0987		1.9071
H5	1.0800	2.0397	3.0987	1.9071

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	N3	180.000		N2	C1	H4	118.004
N2	C1	H5	118.004		H4	C1	H5	123.992

All results from a given calculation for CH₂NN (diazomethane)

using model chemistry: B3LYP/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	-0.475
2	N	0.216
3	N	-0.082
4	H	0.171
5	H	0.171

	x	y	z	Total
	0.000	0.000	-1.775	1.775
CHELPG
AIM
ESP

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for CH2NN (diazomethane)

using model chemistry: B3LYP/6-31+G**

States and conformations

All results from a given calculation for CH₂NN (diazomethane)