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	hartrees
Energy at 0K	-148.657753
Energy at 298.15K	-148.659987
HF Energy	-148.657753
Nuclear repulsion energy	59.985816

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3142	3118	11.78
2	A₁	2050	2035	220.32
3	A₁	1425	1415	28.75
4	A₁	1161	1152	0.01
5	B₁	556	552	128.78
6	B₁	501	497	34.57
7	B₂	3258	3233	0.01
8	B₂	1108	1100	1.81
9	B₂	398	395	0.03

Atom	y (Å)	z (Å)
C1	0.000	-1.160
N2	0.000	0.149
N3	0.000	1.327
H4	0.952	-1.684
H5	-0.952	-1.684

	C1	N2	N3	H4	H5
C1		1.3086	2.4868	1.0866	1.0866
N2	1.3086		1.1782	2.0649	2.0649
N3	2.4868	1.1782		3.1575	3.1575
H4	1.0866	2.0649	3.1575		1.9041
H5	1.0866	2.0649	3.1575	1.9041

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	N3	180.000		N2	C1	H4	118.817
N2	C1	H5	118.817		H4	C1	H5	122.365

All results from a given calculation for CH₂NN (diazomethane)

using model chemistry: BLYP/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	-0.192
2	N	-0.043
3	N	-0.093
4	H	0.164
5	H	0.164

	x	y	z	Total
	0.000	0.000	-1.893	1.893
CHELPG
AIM
ESP

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for CH2NN (diazomethane)

using model chemistry: BLYP/6-31G

States and conformations

All results from a given calculation for CH₂NN (diazomethane)