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	hartrees
Energy at 0K	-133.136189
Energy at 298.15K	-133.141647
HF Energy	-133.136189
Nuclear repulsion energy	70.752287

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3052	3032	43.30
2	A'	3008	2989	21.66
3	A'	2898	2879	80.08
4	A'	2885	2867	38.84
5	A'	1630	1619	13.97
6	A'	1524	1514	21.68
7	A'	1485	1475	1.27
8	A'	1421	1412	6.53
9	A'	1199	1191	5.04
10	A'	1101	1094	1.86
11	A'	842	837	10.07
12	A'	456	453	6.94
13	A"	3031	3012	18.96
14	A"	1510	1500	4.85
15	A"	1115	1108	0.09
16	A"	1034	1027	26.08
17	A"	687	682	1.40
18	A"	231	229	8.32

Atom	x (Å)	y (Å)	z (Å)
C1	-1.100	-0.447	0.000
N2	0.000	0.572	0.000
C3	1.210	0.134	0.000
H4	-0.743	-1.498	0.000
H5	-1.726	-0.273	0.890
H6	-1.726	-0.273	-0.890
H7	1.497	-0.937	0.000
H8	2.039	0.853	0.000

	C1	N2	C3	H4	H5	H6	H7	H8
C1		1.4991	2.3820	1.1104	1.1022	1.1022	2.6429	3.3973
N2	1.4991		1.2865	2.1991	2.1179	2.1179	2.1251	2.0581
C3	2.3820	1.2865		2.5453	3.0949	3.0949	1.1089	1.0970
H4	1.1104	2.1991	2.5453		1.8056	1.8056	2.3093	3.6422
H5	1.1022	2.1179	3.0949	1.8056		1.7808	3.4090	4.0292
H6	1.1022	2.1179	3.0949	1.8056	1.7808		3.4090	4.0292
H7	2.6429	2.1251	1.1089	2.3093	3.4090	3.4090		1.8699
H8	3.3973	2.0581	1.0970	3.6422	4.0292	4.0292	1.8699

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	C3	117.339	N2	C1	H4	114.028
N2	C1	H5	108.037	N2	C1	H6	108.037
N2	C3	H7	124.876	N2	C3	H8	119.206
H4	C1	H5	109.388	H4	C1	H6	109.388
H5	C1	H6	107.773	H7	C3	H8	115.918

All results from a given calculation for CH₂NCH₃ (N-methylmethanimine)

using model chemistry: BLYP/3-21G*

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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Number	Element	Mulliken
1	C	-0.415
2	N	-0.363
3	C	-0.119
4	H	0.159
5	H	0.206
6	H	0.206
7	H	0.143
8	H	0.183

	x	y	z	Total
	0.126	-1.432	0.000	1.438
CHELPG
AIM
ESP

	x	y	z
x	5.891	0.186	0.000
y	0.186	3.760	0.000
z	0.000	0.000	2.397

<r²>	49.959
(<r²>)^1/2	7.068

All results from a given calculation for CH2NCH3 (N-methylmethanimine)

using model chemistry: BLYP/3-21G*

States and conformations

All results from a given calculation for CH₂NCH₃ (N-methylmethanimine)