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	hartrees
Energy at 0K	-24.135844
Energy at 298.15K	-24.141320
HF Energy	-24.135844
Nuclear repulsion energy	40.354833

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3177	3077	54.48
2	A'	3090	2993	48.03
3	A'	3003	2908	106.12
4	A'	2973	2879	92.78
5	A'	1675	1622	11.69
6	A'	1514	1466	27.11
7	A'	1487	1440	3.73
8	A'	1449	1403	1.29
9	A'	1226	1187	4.31
10	A'	1119	1084	2.43
11	A'	932	902	10.60
12	A'	452	437	6.62
13	A"	3117	3019	43.22
14	A"	1486	1439	8.28
15	A"	1140	1104	0.31
16	A"	1066	1032	49.15
17	A"	689	668	0.57
18	A"	220	213	12.85

Atom	x (Å)	y (Å)	z (Å)
C1	-1.106	-0.430	0.000
N2	0.000	0.560	0.000
C3	1.223	0.126	0.000
H4	-0.768	-1.490	0.000
H5	-1.737	-0.252	0.888
H6	-1.737	-0.252	-0.888
H7	1.496	-0.950	0.000
H8	2.045	0.852	0.000

	C1	N2	C3	H4	H5	H6	H7	H8
C1		1.4841	2.3938	1.1122	1.1037	1.1037	2.6539	3.4014
N2	1.4841		1.2973	2.1883	2.1125	2.1125	2.1261	2.0654
C3	2.3938	1.2973		2.5630	3.1125	3.1125	1.1104	1.0970
H4	1.1122	2.1883	2.5630		1.8056	1.8056	2.3273	3.6594
H5	1.1037	2.1125	3.1125	1.8056		1.7755	3.4250	4.0380
H6	1.1037	2.1125	3.1125	1.8056	1.7755		3.4250	4.0380
H7	2.6539	2.1261	1.1104	2.3273	3.4250	3.4250		1.8840
H8	3.4014	2.0654	1.0970	3.6594	4.0380	4.0380	1.8840

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	C3	118.622	N2	C1	H4	114.120
N2	C1	H5	108.548	N2	C1	H6	108.548
N2	C3	H7	123.832	N2	C3	H8	118.990
H4	C1	H5	109.148	H4	C1	H6	109.148
H5	C1	H6	107.098	H7	C3	H8	117.177

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

using model chemistry: B3LYP/CEP-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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Number	Element	Mulliken
1	C	-0.516
2	N	0.162
3	C	-0.559
4	H	0.147
5	H	0.194
6	H	0.194
7	H	0.160
8	H	0.218

	x	y	z	Total
	0.311	-2.031	0.000	2.055
CHELPG
AIM
ESP

<r²>	43.609
(<r²>)^1/2	6.604

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

using model chemistry: B3LYP/CEP-31G

States and conformations

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