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	hartrees
Energy at 0K	-132.666879
Energy at 298.15K	-132.670850
HF Energy	-132.417596
Nuclear repulsion energy	63.896778

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3188	3029	8.60
2	A'	3081	2927	3.42
3	A'	3072	2919	24.86
4	A'	1842	1750	5.24
5	A'	1559	1481	12.50
6	A'	1477	1403	6.11
7	A'	1343	1276	3.31
8	A'	1116	1060	12.93
9	A'	955	907	1.48
10	A'	468	445	21.95
11	A"	3165	3007	11.05
12	A"	1555	1477	12.76
13	A"	1199	1139	2.59
14	A"	837	795	11.53
15	A"	190	181	2.13

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.485	0.000
C2	-0.835	-0.787	0.000
N3	1.243	0.525	0.000
H4	-0.560	1.432	0.000
H5	-0.181	-1.666	0.000
H6	-1.476	-0.813	0.890
H7	-1.476	-0.813	-0.890

	C1	C2	N3	H4	H5	H6	H7
C1		1.5216	1.2440	1.1005	2.1588	2.1580	2.1580
C2	1.5216		2.4579	2.2364	1.0953	1.0976	1.0976
N3	1.2440	2.4579		2.0187	2.6137	3.1591	3.1591
H4	1.1005	2.2364	2.0187		3.1215	2.5833	2.5833
H5	2.1588	1.0953	2.6137	3.1215		1.7882	1.7882
H6	2.1580	1.0976	3.1591	2.5833	1.7882		1.7804
H7	2.1580	1.0976	3.1591	2.5833	1.7882	1.7804

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.092	C1	C2	H6	109.896
C1	C2	H7	109.896	C2	C1	N3	125.125
C2	C1	H4	116.134	N3	C1	H4	118.741
H5	C2	H6	109.265	H5	C2	H7	109.265
H6	C2	H7	108.396

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

using model chemistry: MP2=FULL/6-31G

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: MP2=FULL/6-31G

States and conformations

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