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	hartrees
Energy at 0K	-132.890191
Energy at 298.15K	-132.894151
HF Energy	-132.480665
Nuclear repulsion energy	64.662776

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3275	3061	4.88
2	A'	3149	2942	5.15
3	A'	3114	2910	18.00
4	A'	2128	1989	67.59
5	A'	1541	1440	10.49
6	A'	1446	1351	3.71
7	A'	1307	1221	3.24
8	A'	1106	1034	11.42
9	A'	956	894	1.27
10	A'	448	419	21.68
11	A"	3244	3031	7.02
12	A"	1543	1442	9.22
13	A"	1169	1092	1.01
14	A"	812	758	6.70
15	A"	205	191	2.04

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.482	0.000
C2	-0.823	-0.779	0.000
N3	1.226	0.514	0.000
H4	-0.549	1.429	0.000
H5	-0.175	-1.649	0.000
H6	-1.461	-0.798	0.880
H7	-1.461	-0.798	-0.880

	C1	C2	N3	H4	H5	H6	H7
C1		1.5051	1.2264	1.0952	2.1376	2.1321	2.1321
C2	1.5051		2.4223	2.2248	1.0844	1.0874	1.0874
N3	1.2264	2.4223		1.9972	2.5771	3.1167	3.1167
H4	1.0952	2.2248	1.9972		3.1006	2.5625	2.5625
H5	2.1376	1.0844	2.5771	3.1006		1.7750	1.7750
H6	2.1321	1.0874	3.1167	2.5625	1.7750		1.7609
H7	2.1321	1.0874	3.1167	2.5625	1.7750	1.7609

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.222	C1	C2	H6	109.604
C1	C2	H7	109.604	C2	C1	N3	124.642
C2	C1	H4	116.773	N3	C1	H4	118.585
H5	C2	H6	109.626	H5	C2	H7	109.626
H6	C2	H7	108.126

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)