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	hartrees
Energy at 0K	-189.226744
Energy at 298.15K
HF Energy	-189.226744
Nuclear repulsion energy	122.531817

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3158	3041	1.81
2	A₁	3020	2908	17.62
3	A₁	1683	1621	15.79
4	A₁	1484	1428	0.30
5	A₁	1413	1360	27.86
6	A₁	1102	1061	5.36
7	A₁	883	850	0.08
8	A₁	367	353	0.76
9	A₂	3091	2975	0.00
10	A₂	1493	1438	0.00
11	A₂	1094	1053	0.00
12	A₂	482	464	0.00
13	A₂	41i	40i	0.00
14	B₁	3085	2970	42.25
15	B₁	1518	1462	29.39
16	B₁	946	911	1.61
17	B₁	190	183	0.08
18	B₂	3157	3039	35.57
19	B₂	3020	2907	3.04
20	B₂	1473	1418	18.51
21	B₂	1395	1343	1.15
22	B₂	1180	1136	13.58
23	B₂	958	922	18.64
24	B₂	631	608	0.34

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.618	-0.778
N2	0.000	-0.618	-0.778
C3	0.000	1.354	0.498
C4	0.000	-1.354	0.498
H5	0.000	2.418	0.265
H6	0.000	-2.418	0.265
H7	-0.887	1.120	1.098
H8	0.887	1.120	1.098
H9	0.887	-1.120	1.098
H10	-0.887	-1.120	1.098

	N1	N2	C3	C4	H5	H6	H7	H8	H9	H10
N1		1.2352	1.4730	2.3485	2.0801	3.2093	2.1348	2.1348	2.7062	2.7062
N2	1.2352		2.3485	1.4730	3.2093	2.0801	2.7062	2.7062	2.1348	2.1348
C3	1.4730	2.3485		2.7088	1.0884	3.7792	1.0962	1.0962	2.6959	2.6959
C4	2.3485	1.4730	2.7088		3.7792	1.0884	2.6959	2.6959	1.0962	1.0962
H5	2.0801	3.2093	1.0884	3.7792		4.8352	1.7790	1.7790	3.7408	3.7408
H6	3.2093	2.0801	3.7792	1.0884	4.8352		3.7408	3.7408	1.7790	1.7790
H7	2.1348	2.7062	1.0962	2.6959	1.7790	3.7408		1.7733	2.8566	2.2395
H8	2.1348	2.7062	1.0962	2.6959	1.7790	3.7408	1.7733		2.2395	2.8566
H9	2.7062	2.1348	2.6959	1.0962	3.7408	1.7790	2.8566	2.2395		1.7733
H10	2.7062	2.1348	2.6959	1.0962	3.7408	1.7790	2.2395	2.8566	1.7733

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	C4	120.013	N1	C3	H5	107.657
N1	C3	H7	111.543	N1	C3	H8	111.543
N2	N1	C3	120.013	N2	C4	H6	107.657
N2	C4	H9	111.543	N2	C4	H10	111.543
H5	C3	H7	109.043	H5	C3	H8	109.043
H6	C4	H9	109.043	H6	C4	H10	109.043
H7	C3	H8	107.966	H9	C4	H10	107.966

All results from a given calculation for CH₃NNCH₃ ((Z)-1,2-Dimethyldiazene)

using model chemistry: B3PW91/6-311G*

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	N	-0.113
2	N	-0.113
3	C	-0.612
4	C	-0.612
5	H	0.250
6	H	0.250
7	H	0.238
8	H	0.238
9	H	0.238
10	H	0.238

<r²>	79.636
(<r²>)^1/2	8.924

All results from a given calculation for CH3NNCH3 ((Z)-1,2-Dimethyldiazene)

using model chemistry: B3PW91/6-311G*

States and conformations

All results from a given calculation for CH₃NNCH₃ ((Z)-1,2-Dimethyldiazene)