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	hartrees
Energy at 0K	-148.590251
Energy at 298.15K	-148.592393
HF Energy	-148.433272
Nuclear repulsion energy	60.899627

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3249	3084	15.72
2	A₁	2220	2108	284.66
3	A₁	1470	1396	25.16
4	A₁	1211	1149	1.05
5	B₁	573	544	2.36
6	B₁	356	337	150.67
7	B₂	3373	3202	1.38
8	B₂	1135	1077	1.46
9	B₂	425	403	0.46

Atom	y (Å)	z (Å)
C1	0.000	-1.147
N2	0.000	0.152
N3	0.000	1.303
H4	0.953	-1.651
H5	-0.953	-1.651

	C1	N2	N3	H4	H5
C1		1.2984	2.4498	1.0779	1.0779
N2	1.2984		1.1514	2.0388	2.0388
N3	2.4498	1.1514		3.1037	3.1037
H4	1.0779	2.0388	3.1037		1.9056
H5	1.0779	2.0388	3.1037	1.9056

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	N3	180.000		N2	C1	H4	117.878
N2	C1	H5	117.878		H4	C1	H5	124.245

All results from a given calculation for CH₂NN (diazomethane)

using model chemistry: B2PLYP/6-31G*

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	-0.354
2	N	0.145
3	N	-0.198
4	H	0.204
5	H	0.204

<r²>	38.187
(<r²>)^1/2	6.180

All results from a given calculation for CH2NN (diazomethane)

using model chemistry: B2PLYP/6-31G*

States and conformations

All results from a given calculation for CH₂NN (diazomethane)