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	hartrees
Energy at 0K	-147.860574
Energy at 298.15K	-147.862991
HF Energy	-147.860574
Nuclear repulsion energy	62.129081

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3353	3072	13.66
2	A₁	2319	2125	805.83
3	A₁	1545	1416	75.16
4	A₁	1298	1190	24.58
5	B₁	659	604	3.41
6	B₁	537	492	169.52
7	B₂	3498	3205	0.81
8	B₂	1220	1118	3.96
9	B₂	450	412	0.93

Atom	y (Å)	z (Å)
C1	0.000	-1.128
N2	0.000	0.160
N3	0.000	1.271
H4	0.953	-1.624
H5	-0.953	-1.624

	C1	N2	N3	H4	H5
C1		1.2875	2.3993	1.0746	1.0746
N2	1.2875		1.1118	2.0224	2.0224
N3	2.3993	1.1118		3.0484	3.0484
H4	1.0746	2.0224	3.0484		1.9062
H5	1.0746	2.0224	3.0484	1.9062

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	N3	180.000		N2	C1	H4	117.504
N2	C1	H5	117.504		H4	C1	H5	124.992

All results from a given calculation for CH₂NN (diazomethane)

using model chemistry: HF/cc-pCVDZ

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	-0.136
2	N	0.112
3	N	-0.134
4	H	0.079
5	H	0.079

	x	y	z	Total
	0.000	0.000	-1.296	1.296
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-pCVDZ

States and conformations

All results from a given calculation for CH₂NN (diazomethane)