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	hartrees
Energy at 0K	-203.615037
Energy at 298.15K	-203.619604
HF Energy	-202.905372
Nuclear repulsion energy	107.495863

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3152	3034
2	A'	3015	2902
3	A'	2161	2081
4	A'	1514	1458
5	A'	1472	1417
6	A'	1309	1260
7	A'	1158	1115
8	A'	936	901
9	A'	651	627
10	A'	241	232
11	A"	3084	2969
12	A"	1515	1458
13	A"	1120	1078
14	A"	535	515
15	A"	111	107

Atom	x (Å)	y (Å)	z (Å)
C1	-0.081	-1.564	0.000
N2	0.701	-0.309	0.000
N3	0.000	0.718	0.000
N4	-0.521	1.742	0.000
H5	0.646	-2.380	0.000
H6	-0.710	-1.645	0.897
H7	-0.710	-1.645	-0.897

	C1	N2	N3	N4	H5	H6	H7
C1		1.4789	2.2837	3.3357	1.0919	1.0985	1.0985
N2	1.4789		1.2435	2.3878	2.0711	2.1400	2.1400
N3	2.2837	1.2435		1.1492	3.1640	2.6248	2.6248
N4	3.3357	2.3878	1.1492		4.2836	3.5084	3.5084
H5	1.0919	2.0711	3.1640	4.2836		1.7842	1.7842
H6	1.0985	2.1400	2.6248	3.5084	1.7842		1.7931
H7	1.0985	2.1400	2.6248	3.5084	1.7842	1.7931

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	N3	113.757	N2	C1	H5	106.365
N2	C1	H6	111.407	N2	C1	H7	111.407
N2	N3	N4	172.647	H5	C1	H6	109.084
H5	C1	H7	109.084	H6	C1	H7	109.407

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

using model chemistry: QCISD(T)/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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All results from a given calculation for CH3N3 (methyl azide)

using model chemistry: QCISD(T)/6-311G*

States and conformations

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