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	hartrees
Energy at 0K	-203.582743
Energy at 298.15K	-203.587352
HF Energy	-202.889176
Nuclear repulsion energy	106.809571

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3219	3119	5.91
2	A'	3063	2968	44.77
3	A'	2324	2252	368.81
4	A'	1490	1444	14.47
5	A'	1430	1386	10.45
6	A'	1305	1264	118.72
7	A'	1141	1106	9.94
8	A'	924	896	18.01
9	A'	672	651	8.35
10	A'	227	220	7.70
11	A"	3151	3054	21.50
12	A"	1489	1443	7.38
13	A"	1108	1074	0.78
14	A"	514	499	2.47
15	A"	148	143	0.58

Atom	x (Å)	y (Å)	z (Å)
C1	-0.082	-1.576	0.000
N2	0.698	-0.316	0.000
N3	0.000	0.719	0.000
N4	-0.517	1.763	0.000
H5	0.652	-2.388	0.000
H6	-0.711	-1.654	0.901
H7	-0.711	-1.654	-0.901

	C1	N2	N3	N4	H5	H6	H7
C1		1.4818	2.2965	3.3671	1.0944	1.1012	1.1012
N2	1.4818		1.2483	2.4078	2.0719	2.1411	2.1411
N3	2.2965	1.2483		1.1649	3.1743	2.6355	2.6355
N4	3.3671	2.4078	1.1649		4.3119	3.5384	3.5384
H5	1.0944	2.0719	3.1743	4.3119		1.7911	1.7911
H6	1.1012	2.1411	2.6355	3.5384	1.7911		1.8012
H7	1.1012	2.1411	2.6355	3.5384	1.7911	1.8012

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	N3	114.262	N2	C1	H5	106.102
N2	C1	H6	111.126	N2	C1	H7	111.126
N2	N3	N4	172.371	H5	C1	H6	109.330
H5	C1	H7	109.330	H6	C1	H7	109.741

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

using model chemistry: MP2=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: MP2=FULL/aug-cc-pVDZ

States and conformations

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