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	hartrees
Energy at 0K	-203.527501
Energy at 298.15K	-203.532142
HF Energy	-202.883936
Nuclear repulsion energy	108.085243

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3217	3049	10.29
2	A'	3070	2910	43.18
3	A'	2369	2245	520.76
4	A'	1500	1422	16.98
5	A'	1461	1385	9.99
6	A'	1358	1287	143.44
7	A'	1164	1104	12.17
8	A'	977	926	16.85
9	A'	689	653	4.52
10	A'	252	239	4.76
11	A"	3143	2979	34.07
12	A"	1500	1422	6.13
13	A"	1113	1055	0.98
14	A"	585	555	13.10
15	A"	105	99	0.65

Atom	x (Å)	y (Å)	z (Å)
C1	-0.063	-1.543	0.000
N2	0.722	-0.293	0.000
N3	0.000	0.718	0.000
N4	-0.563	1.702	0.000
H5	0.661	-2.368	0.000
H6	-0.700	-1.632	0.899
H7	-0.700	-1.632	-0.899

	C1	N2	N3	N4	H5	H6	H7
C1		1.4766	2.2618	3.2837	1.0978	1.1052	1.1052
N2	1.4766		1.2425	2.3735	2.0761	2.1501	2.1501
N3	2.2618	1.2425		1.1340	3.1559	2.6111	2.6111
N4	3.2837	2.3735	1.1340		4.2504	3.4559	3.4559
H5	1.0978	2.0761	3.1559	4.2504		1.7894	1.7894
H6	1.1052	2.1501	2.6111	3.4559	1.7894		1.7990
H7	1.1052	2.1501	2.6111	3.4559	1.7894	1.7990

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	N3	112.286	N2	C1	H5	106.568
N2	C1	H6	111.967	N2	C1	H7	111.967
N2	N3	N4	174.188	H5	C1	H6	108.632
H5	C1	H7	108.632	H6	C1	H7	108.952

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

using model chemistry: MP3/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: MP3/cc-pVDZ

States and conformations

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