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	hartrees
Energy at 0K	-147.867596
Energy at 298.15K	-147.870003
HF Energy	-147.867596
Nuclear repulsion energy	62.068820

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3350	3050	11.80
2	A₁	2292	2087	927.46
3	A₁	1546	1407	84.59
4	A₁	1289	1174	37.10
5	B₁	649	591	13.39
6	B₁	538	489	152.46
7	B₂	3494	3181	0.45
8	B₂	1221	1112	6.05
9	B₂	453	413	0.30

Atom	y (Å)	z (Å)
C1	0.000	-1.130
N2	0.000	0.160
N3	0.000	1.273
H4	0.952	-1.625
H5	-0.952	-1.625

	C1	N2	N3	H4	H5
C1		1.2892	2.4024	1.0734	1.0734
N2	1.2892		1.1132	2.0225	2.0225
N3	2.4024	1.1132		3.0500	3.0500
H4	1.0734	2.0225	3.0500		1.9049
H5	1.0734	2.0225	3.0500	1.9049

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	N3	180.000		N2	C1	H4	117.462
N2	C1	H5	117.462		H4	C1	H5	125.077

All results from a given calculation for CH₂NN (diazomethane)

using model chemistry: HF/aug-cc-pVDZ

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	0.611
2	N	0.128
3	N	-0.306
4	H	-0.216
5	H	-0.216

	x	y	z	Total
	0.000	0.000	-1.378	1.378
CHELPG
AIM
ESP

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for CH2NN (diazomethane)

using model chemistry: HF/aug-cc-pVDZ

States and conformations

All results from a given calculation for CH₂NN (diazomethane)