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	hartrees
Energy at 0K	-147.877516
Energy at 298.15K	-147.879930
HF Energy	-147.877516
Nuclear repulsion energy	62.350341

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3352	3031	6.74
2	A₁	2294	2075	845.78
3	A₁	1571	1420	76.90
4	A₁	1300	1176	26.52
5	B₁	661	598	4.07
6	B₁	538	487	186.03
7	B₂	3486	3153	0.06
8	B₂	1250	1131	3.68
9	B₂	460	416	0.60

Atom	y (Å)	z (Å)
C1	0.000	-1.124
N2	0.000	0.159
N3	0.000	1.267
H4	0.946	-1.620
H5	-0.946	-1.620

	C1	N2	N3	H4	H5
C1		1.2838	2.3916	1.0680	1.0680
N2	1.2838		1.1078	2.0156	2.0156
N3	2.3916	1.1078		3.0387	3.0387
H4	1.0680	2.0156	3.0387		1.8917
H5	1.0680	2.0156	3.0387	1.8917

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	N3	180.000		N2	C1	H4	117.675
N2	C1	H5	117.675		H4	C1	H5	124.649

All results from a given calculation for CH₂NN (diazomethane)

using model chemistry: HF/6-311G*

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	-0.482
2	N	0.112
3	N	-0.152
4	H	0.261
5	H	0.261

	x	y	z	Total
	0.000	0.000	-1.380	1.380
CHELPG
AIM
ESP

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for CH2NN (diazomethane)

using model chemistry: HF/6-311G*

States and conformations

All results from a given calculation for CH₂NN (diazomethane)