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	hartrees
Energy at 0K	-133.072935
Energy at 298.15K	-133.077031
HF Energy	-132.523547
Nuclear repulsion energy	64.411469

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3167	3082
2	A'	3059	2977
3	A'	3006	2926
4	A'	2043	1988
5	A'	1508	1467
6	A'	1377	1340
7	A'	1270	1236
8	A'	1074	1046
9	A'	937	912
10	A'	452	440
11	A"	3126	3043
12	A"	1515	1474
13	A"	1132	1101
14	A"	790	769
15	A"	314	306

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.483	0.000
C2	-0.823	-0.786	0.000
N3	1.228	0.521	0.000
H4	-0.551	1.436	0.000
H5	-0.176	-1.661	0.000
H6	-1.465	-0.802	0.884
H7	-1.465	-0.802	-0.884

	C1	C2	N3	H4	H5	H6	H7
C1		1.5127	1.2289	1.1003	2.1518	2.1402	2.1402
C2	1.5127		2.4326	2.2380	1.0889	1.0924	1.0924
N3	1.2289	2.4326		2.0006	2.5954	3.1285	3.1285
H4	1.1003	2.2380	2.0006		3.1197	2.5740	2.5740
H5	2.1518	1.0889	2.5954	3.1197		1.7834	1.7834
H6	2.1402	1.0924	3.1285	2.5740	1.7834		1.7677
H7	2.1402	1.0924	3.1285	2.5740	1.7834	1.7677

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.550	C1	C2	H6	109.422
C1	C2	H7	109.422	C2	C1	N3	124.748
C2	C1	H4	116.972	N3	C1	H4	118.280
H5	C2	H6	109.692	H5	C2	H7	109.692
H6	C2	H7	108.020

All results from a given calculation for CH₃CHN (methylmethaniminyl radical)

using model chemistry: MP4/aug-cc-pVTZ

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 CH3CHN (methylmethaniminyl radical)

using model chemistry: MP4/aug-cc-pVTZ

States and conformations

All results from a given calculation for CH₃CHN (methylmethaniminyl radical)