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	hartrees
Energy at 0K	-203.602335
Energy at 298.15K	-203.606867
HF Energy	-202.931425
Nuclear repulsion energy	108.976767

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3223	3015	10.69
2	A'	3080	2880	43.89
3	A'	2355	2203	634.47
4	A'	1526	1427	17.93
5	A'	1503	1405	11.70
6	A'	1345	1258	178.13
7	A'	1182	1106	9.23
8	A'	969	906	17.87
9	A'	675	631	5.07
10	A'	241	225	4.55
11	A"	3146	2942	33.77
12	A"	1514	1416	6.97
13	A"	1139	1065	1.68
14	A"	490	458	13.83
15	A"	89	84	0.88

Atom	x (Å)	y (Å)	z (Å)
C1	-0.069	-1.535	0.000
N2	0.717	-0.290	0.000
N3	0.000	0.714	0.000
N4	-0.551	1.690	0.000
H5	0.643	-2.352	0.000
H6	-0.696	-1.616	0.890
H7	-0.696	-1.616	-0.890

	C1	N2	N3	N4	H5	H6	H7
C1		1.4720	2.2493	3.2602	1.0843	1.0917	1.0917
N2	1.4720		1.2334	2.3509	2.0637	2.1327	2.1327
N3	2.2493	1.2334		1.1209	3.1327	2.5895	2.5895
N4	3.2602	2.3509	1.1209		4.2148	3.4269	3.4269
H5	1.0843	2.0637	3.1327	4.2148		1.7684	1.7684
H6	1.0917	2.1327	2.5895	3.4269	1.7684		1.7793
H7	1.0917	2.1327	2.5895	3.4269	1.7684	1.7793

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	N3	112.186	N2	C1	H5	106.685
N2	C1	H6	111.730	N2	C1	H7	111.730
N2	N3	N4	173.889	H5	C1	H6	108.717
H5	C1	H7	108.717	H6	C1	H7	109.151

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

using model chemistry: MP3/TZVP

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/TZVP

States and conformations

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