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	hartrees
Energy at 0K	-189.070523
Energy at 298.15K
HF Energy	-189.070523
Nuclear repulsion energy	122.861241

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3176	3044	1.63
2	A₁	3034	2908	16.75
3	A₁	1710	1639	15.51
4	A₁	1487	1426	0.38
5	A₁	1418	1359	27.83
6	A₁	1107	1061	5.13
7	A₁	904	866	0.20
8	A₁	374	359	0.74
9	A₂	3106	2977	0.00
10	A₂	1496	1434	0.00
11	A₂	1099	1054	0.00
12	A₂	486	466	0.00
13	A₂	25i	24i	0.00
14	B₁	3101	2972	39.96
15	B₁	1522	1458	30.51
16	B₁	950	911	1.68
17	B₁	202	194	0.09
18	B₂	3175	3043	33.40
19	B₂	3034	2908	2.84
20	B₂	1475	1414	19.67
21	B₂	1399	1341	1.13
22	B₂	1185	1136	13.54
23	B₂	981	940	16.87
24	B₂	637	611	0.46

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.616	-0.777
N2	0.000	-0.616	-0.777
C3	0.000	1.347	0.496
C4	0.000	-1.347	0.496
H5	0.000	2.411	0.268
H6	0.000	-2.411	0.268
H7	-0.886	1.111	1.096
H8	0.886	1.111	1.096
H9	0.886	-1.111	1.096
H10	-0.886	-1.111	1.096

	N1	N2	C3	C4	H5	H6	H7	H8	H9	H10
N1		1.2329	1.4680	2.3404	2.0767	3.2029	2.1304	2.1304	2.6976	2.6976
N2	1.2329		2.3404	1.4680	3.2029	2.0767	2.6976	2.6976	2.1304	2.1304
C3	1.4680	2.3404		2.6950	1.0882	3.7658	1.0962	1.0962	2.6811	2.6811
C4	2.3404	1.4680	2.6950		3.7658	1.0882	2.6811	2.6811	1.0962	1.0962
H5	2.0767	3.2029	1.0882	3.7658		4.8228	1.7787	1.7787	3.7252	3.7252
H6	3.2029	2.0767	3.7658	1.0882	4.8228		3.7252	3.7252	1.7787	1.7787
H7	2.1304	2.6976	1.0962	2.6811	1.7787	3.7252		1.7722	2.8417	2.2214
H8	2.1304	2.6976	1.0962	2.6811	1.7787	3.7252	1.7722		2.2214	2.8417
H9	2.6976	2.1304	2.6811	1.0962	3.7252	1.7787	2.8417	2.2214		1.7722
H10	2.6976	2.1304	2.6811	1.0962	3.7252	1.7787	2.2214	2.8417	1.7722

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	C4	119.868	N1	C3	H5	107.746
N1	C3	H7	111.550	N1	C3	H8	111.550
N2	N1	C3	119.868	N2	C4	H6	107.746
N2	C4	H9	111.550	N2	C4	H10	111.550
H5	C3	H7	109.040	H5	C3	H8	109.040
H6	C4	H9	109.040	H6	C4	H10	109.040
H7	C3	H8	107.869	H9	C4	H10	107.869

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

using model chemistry: PBE1PBE/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	-0.111
2	N	-0.111
3	C	-0.626
4	C	-0.626
5	H	0.253
6	H	0.253
7	H	0.242
8	H	0.242
9	H	0.242
10	H	0.242

<r²>	79.235
(<r²>)^1/2	8.901

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

using model chemistry: PBE1PBE/6-311G*

States and conformations

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