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	hartrees
Energy at 0K	-203.621033
Energy at 298.15K	-203.625611
HF Energy	-202.890897
Nuclear repulsion energy	106.895230

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3160	3069
2	A'	3020	2933
3	A'	2139	2077
4	A'	1480	1437
5	A'	1425	1384
6	A'	1282	1245
7	A'	1137	1105
8	A'	924	897
9	A'	640	621
10	A'	236	229
11	A"	3094	3005
12	A"	1481	1438
13	A"	1096	1064
14	A"	520	505
15	A"	131	128

Atom	x (Å)	y (Å)	z (Å)
C1	-0.083	-1.567	0.000
N2	0.714	-0.312	0.000
N3	0.000	0.719	0.000
N4	-0.529	1.747	0.000
H5	0.642	-2.393	0.000
H6	-0.716	-1.640	0.903
H7	-0.716	-1.640	-0.903

	C1	N2	N3	N4	H5	H6	H7
C1		1.4871	2.2877	3.3445	1.0985	1.1050	1.1050
N2	1.4871		1.2535	2.4049	2.0822	2.1503	2.1503
N3	2.2877	1.2535		1.1565	3.1770	2.6255	2.6255
N4	3.3445	2.4049	1.1565		4.3023	3.5107	3.5107
H5	1.0985	2.0822	3.1770	4.3023		1.7959	1.7959
H6	1.1050	2.1503	2.6255	3.5107	1.7959		1.8061
H7	1.1050	2.1503	2.6255	3.5107	1.7959	1.8061

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	N3	112.903	N2	C1	H5	106.300
N2	C1	H6	111.251	N2	C1	H7	111.251
N2	N3	N4	172.532	H5	C1	H6	109.171
H5	C1	H7	109.171	H6	C1	H7	109.610

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

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

using model chemistry: CCSD(T)=FULL/aug-cc-pVDZ

States and conformations

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