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	hartrees
Energy at 0K	-189.059222
Energy at 298.15K	-189.066667
HF Energy	-189.059222
Nuclear repulsion energy	122.722391

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3182	3059	0.21
2	A₁	3030	2914	14.26
3	A₁	1703	1637	11.71
4	A₁	1446	1391	0.40
5	A₁	1371	1319	20.24
6	A₁	1085	1044	3.90
7	A₁	917	882	0.09
8	A₁	371	357	0.96
9	A₂	3114	2995	0.00
10	A₂	1453	1397	0.00
11	A₂	1076	1035	0.00
12	A₂	487	468	0.00
13	A₂	81	78	0.00
14	B₁	3105	2986	25.51
15	B₁	1478	1421	26.58
16	B₁	924	888	3.37
17	B₁	201	193	0.15
18	B₂	3181	3059	26.91
19	B₂	3033	2916	2.49
20	B₂	1432	1377	14.79
21	B₂	1354	1302	1.59
22	B₂	1166	1121	13.05
23	B₂	999	961	12.69
24	B₂	641	616	0.45

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.619	-0.778
N2	0.000	-0.619	-0.778
C3	0.000	1.345	0.497
C4	0.000	-1.345	0.497
H5	0.000	2.415	0.271
H6	0.000	-2.415	0.271
H7	-0.891	1.100	1.096
H8	0.891	1.100	1.096
H9	0.891	-1.100	1.096
H10	-0.891	-1.100	1.096

	N1	N2	C3	C4	H5	H6	H7	H8	H9	H10
N1		1.2383	1.4670	2.3417	2.0801	3.2107	2.1297	2.1297	2.6942	2.6942
N2	1.2383		2.3417	1.4670	3.2107	2.0801	2.6942	2.6942	2.1297	2.1297
C3	1.4670	2.3417		2.6906	1.0935	3.7674	1.1012	1.1012	2.6701	2.6701
C4	2.3417	1.4670	2.6906		3.7674	1.0935	2.6701	2.6701	1.1012	1.1012
H5	2.0801	3.2107	1.0935	3.7674		4.8306	1.7901	1.7901	3.7186	3.7186
H6	3.2107	2.0801	3.7674	1.0935	4.8306		3.7186	3.7186	1.7901	1.7901
H7	2.1297	2.6942	1.1012	2.6701	1.7901	3.7186		1.7812	2.8300	2.1992
H8	2.1297	2.6942	1.1012	2.6701	1.7901	3.7186	1.7812		2.1992	2.8300
H9	2.6942	2.1297	2.6701	1.1012	3.7186	1.7901	2.8300	2.1992		1.7812
H10	2.6942	2.1297	2.6701	1.1012	3.7186	1.7901	2.1992	2.8300	1.7812

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	C4	119.670	N1	C3	H5	107.768
N1	C3	H7	111.248	N1	C3	H8	111.248
N2	N1	C3	119.670	N2	C4	H6	107.768
N2	C4	H9	111.248	N2	C4	H10	111.248
H5	C3	H7	109.303	H5	C3	H8	109.303
H6	C4	H9	109.303	H6	C4	H10	109.303
H7	C3	H8	107.946	H9	C4	H10	107.946

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

using model chemistry: PBE1PBE/aug-cc-pVDZ

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	-0.335
2	N	-0.335
3	C	0.623
4	C	0.623
5	H	-0.317
6	H	-0.317
7	H	0.014
8	H	0.014
9	H	0.014
10	H	0.014

<r²>	79.351
(<r²>)^1/2	8.908

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

using model chemistry: PBE1PBE/aug-cc-pVDZ

States and conformations

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