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	hartrees
Energy at 0K	-133.069710
Energy at 298.15K	-133.073703
HF Energy	-132.522312
Nuclear repulsion energy	63.961434

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3156	3076
2	A'	3058	2980
3	A'	3008	2933
4	A'	1723	1680
5	A'	1492	1455
6	A'	1380	1346
7	A'	1251	1220
8	A'	1062	1035
9	A'	923	899
10	A'	434	423
11	A"	3123	3044
12	A"	1498	1461
13	A"	1078	1051
14	A"	747	729
15	A"	271	264

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.488	0.000
C2	-0.844	-0.769	0.000
N3	1.253	0.494	0.000
H4	-0.529	1.450	0.000
H5	-0.208	-1.653	0.000
H6	-1.485	-0.783	0.883
H7	-1.485	-0.783	-0.883

	C1	C2	N3	H4	H5	H6	H7
C1		1.5141	1.2530	1.0983	2.1505	2.1446	2.1446
C2	1.5141		2.4481	2.2417	1.0887	1.0915	1.0915
N3	1.2530	2.4481		2.0226	2.5964	3.1474	3.1474
H4	1.0983	2.2417	2.0226		3.1195	2.5845	2.5845
H5	2.1505	1.0887	2.5964	3.1195		1.7800	1.7800
H6	2.1446	1.0915	3.1474	2.5845	1.7800		1.7670
H7	2.1446	1.0915	3.1474	2.5845	1.7800	1.7670

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.356	C1	C2	H6	109.722
C1	C2	H7	109.722	C2	C1	N3	124.156
C2	C1	H4	117.318	N3	C1	H4	118.526
H5	C2	H6	109.462	H5	C2	H7	109.462
H6	C2	H7	108.078

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

using model chemistry: CCSD(T)/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: CCSD(T)/cc-pVTZ

States and conformations

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