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	hartrees
Energy at 0K	-36.522005
Energy at 298.15K	-36.526439
HF Energy	-36.042765
Nuclear repulsion energy	55.700304

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3144	3069	11.85
2	A'	2971	2899	60.26
3	A'	2419	2361	132.22
4	A'	1520	1484	17.43
5	A'	1470	1435	11.75
6	A'	1157	1129	131.31
7	A'	1129	1102	5.13
8	A'	795	776	5.22
9	A'	609	594	13.03
10	A'	218	212	11.58
11	A"	3075	3002	43.76
12	A"	1500	1464	7.39
13	A"	1110	1083	0.94
14	A"	381	372	2.37
15	A"	166	162	2.47

Atom	x (Å)	y (Å)	z (Å)
C1	-0.193	-1.662	0.000
N2	0.653	-0.388	0.000
N3	0.000	0.753	0.000
N4	-0.330	1.906	0.000
H5	0.545	-2.471	0.000
H6	-0.821	-1.728	0.904
H7	-0.821	-1.728	-0.904

	C1	N2	N3	N4	H5	H6	H7
C1		1.5293	2.4225	3.5709	1.0955	1.1027	1.1027
N2	1.5293		1.3145	2.4961	2.0858	2.1876	2.1876
N3	2.4225	1.3145		1.1998	3.2698	2.7652	2.7652
N4	3.5709	2.4961	1.1998		4.4641	3.7770	3.7770
H5	1.0955	2.0858	3.2698	4.4641		1.7992	1.7992
H6	1.1027	2.1876	2.7652	3.7770	1.7992		1.8080
H7	1.1027	2.1876	2.7652	3.7770	1.7992	1.8080

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	N3	116.630	N2	C1	H5	104.021
N2	C1	H6	111.405	N2	C1	H7	111.405
N2	N3	N4	166.204	H5	C1	H6	109.860
H5	C1	H7	109.860	H6	C1	H7	110.129

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

using model chemistry: MP2/CEP-121G

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-121G

States and conformations

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