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	hartrees
Energy at 0K	-189.115230
Energy at 298.15K	-189.122690
HF Energy	-189.115230
Nuclear repulsion energy	123.160440

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3161	3038	0.53
2	A₁	3025	2907	13.17
3	A₁	1697	1631	12.29
4	A₁	1469	1412	0.27
5	A₁	1394	1340	21.92
6	A₁	1095	1052	4.79
7	A₁	900	865	0.12
8	A₁	374	359	0.99
9	A₂	3097	2977	0.00
10	A₂	1476	1419	0.00
11	A₂	1090	1048	0.00
12	A₂	488	469	0.00
13	A₂	90	87	0.00
14	B₁	3088	2968	27.87
15	B₁	1499	1441	24.67
16	B₁	934	898	2.45
17	B₁	197	189	0.09
18	B₂	3160	3037	28.60
19	B₂	3027	2909	2.03
20	B₂	1456	1399	14.70
21	B₂	1377	1323	1.83
22	B₂	1177	1131	16.07
23	B₂	976	938	15.44
24	B₂	639	614	0.65

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.615	-0.776
N2	0.000	-0.615	-0.776
C3	0.000	1.343	0.496
C4	0.000	-1.343	0.496
H5	0.000	2.406	0.272
H6	0.000	-2.406	0.272
H7	-0.884	1.101	1.093
H8	0.884	1.101	1.093
H9	0.884	-1.101	1.093
H10	-0.884	-1.101	1.093

	N1	N2	C3	C4	H5	H6	H7	H8	H9	H10
N1		1.2297	1.4654	2.3345	2.0752	3.1975	2.1241	2.1241	2.6869	2.6869
N2	1.2297		2.3345	1.4654	3.1975	2.0752	2.6869	2.6869	2.1241	2.1241
C3	1.4654	2.3345		2.6858	1.0866	3.7557	1.0943	1.0943	2.6666	2.6666
C4	2.3345	1.4654	2.6858		3.7557	1.0866	2.6666	2.6666	1.0943	1.0943
H5	2.0752	3.1975	1.0866	3.7557		4.8123	1.7778	1.7778	3.7089	3.7089
H6	3.1975	2.0752	3.7557	1.0866	4.8123		3.7089	3.7089	1.7778	1.7778
H7	2.1241	2.6869	1.0943	2.6666	1.7778	3.7089		1.7686	2.8241	2.2018
H8	2.1241	2.6869	1.0943	2.6666	1.7778	3.7089	1.7686		2.2018	2.8241
H9	2.6869	2.1241	2.6666	1.0943	3.7089	1.7778	2.8241	2.2018		1.7686
H10	2.6869	2.1241	2.6666	1.0943	3.7089	1.7778	2.2018	2.8241	1.7686

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	C4	119.791	N1	C3	H5	107.894
N1	C3	H7	111.342	N1	C3	H8	111.342
N2	N1	C3	119.791	N2	C4	H6	107.894
N2	C4	H9	111.342	N2	C4	H10	111.342
H5	C3	H7	109.205	H5	C3	H8	109.205
H6	C4	H9	109.205	H6	C4	H10	109.205
H7	C3	H8	107.821	H9	C4	H10	107.821

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

using model chemistry: HSEh1PBE/cc-pVTZ

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	-0.098
2	N	-0.098
3	C	-0.203
4	C	-0.203
5	H	0.116
6	H	0.116
7	H	0.093
8	H	0.093
9	H	0.093
10	H	0.093

<r²>	78.802
(<r²>)^1/2	8.877

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

using model chemistry: HSEh1PBE/cc-pVTZ

States and conformations

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