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	hartrees
Energy at 0K	-36.780966
Energy at 298.15K	-36.785590
HF Energy	-36.159418
Nuclear repulsion energy	57.049823

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3233	3070	13.22
2	A'	3080	2924	55.16
3	A'	2381	2260	271.62
4	A'	1520	1443	14.14
5	A'	1469	1395	16.11
6	A'	1288	1223	115.85
7	A'	1158	1099	4.72
8	A'	923	876	18.16
9	A'	671	637	7.07
10	A'	223	211	7.89
11	A"	3175	3015	38.99
12	A"	1515	1439	6.44
13	A"	1127	1070	0.08
14	A"	536	509	4.58
15	A"	165	156	0.99

Atom	x (Å)	y (Å)	z (Å)
C1	-0.079	-1.583	0.000
N2	0.724	-0.323	0.000
N3	0.000	0.721	0.000
N4	-0.547	1.775	0.000
H5	0.659	-2.397	0.000
H6	-0.711	-1.656	0.904
H7	-0.711	-1.656	-0.904

	C1	N2	N3	N4	H5	H6	H7
C1		1.4947	2.3056	3.3906	1.0985	1.1050	1.1050
N2	1.4947		1.2697	2.4520	2.0751	2.1570	2.1570
N3	2.3056	1.2697		1.1873	3.1865	2.6406	2.6406
N4	3.3906	2.4520	1.1873		4.3423	3.5519	3.5519
H5	1.0985	2.0751	3.1865	4.3423		1.8005	1.8005
H6	1.1050	2.1570	2.6406	3.5519	1.8005		1.8079
H7	1.1050	2.1570	2.6406	3.5519	1.8005	1.8079

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	N3	112.784	N2	C1	H5	105.283
N2	C1	H6	111.253	N2	C1	H7	111.253
N2	N3	N4	172.689	H5	C1	H6	109.588
H5	C1	H7	109.588	H6	C1	H7	109.772

All results from a given calculation for CH₃N₃ (methyl azide)

using model chemistry: MP2/CEP-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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All results from a given calculation for CH3N3 (methyl azide)

using model chemistry: MP2/CEP-31G*

States and conformations

All results from a given calculation for CH₃N₃ (methyl azide)