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	hartrees
Energy at 0K	-189.228987
Energy at 298.15K	-189.236593
HF Energy	-189.228987
Nuclear repulsion energy	123.399791

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3173	3037	0.55
2	A₁	3038	2907	13.39
3	A₁	1698	1626	11.90
4	A₁	1481	1418	0.36
5	A₁	1400	1340	19.53
6	A₁	1104	1056	5.04
7	A₁	900	862	0.14
8	A₁	394	377	0.98
9	A₂	3107	2974	0.00
10	A₂	1485	1421	0.00
11	A₂	1092	1045	0.00
12	A₂	487	466	0.00
13	A₂	110	106	0.00
14	B₁	3102	2969	29.07
15	B₁	1514	1449	23.35
16	B₁	943	902	2.42
17	B₁	257	246	0.21
18	B₂	3172	3036	31.21
19	B₂	3037	2907	1.64
20	B₂	1464	1401	13.07
21	B₂	1381	1322	2.37
22	B₂	1182	1131	17.14
23	B₂	978	936	14.18
24	B₂	639	612	0.59

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.614	-0.777
N2	0.000	-0.614	-0.777
C3	0.000	1.337	0.497
C4	0.000	-1.337	0.497
H5	0.000	2.398	0.278
H6	0.000	-2.398	0.278
H7	-0.882	1.092	1.091
H8	0.882	1.092	1.091
H9	0.882	-1.092	1.091
H10	-0.882	-1.092	1.091

	N1	N2	C3	C4	H5	H6	H7	H8	H9	H10
N1		1.2287	1.4645	2.3303	2.0722	3.1917	2.1199	2.1199	2.6791	2.6791
N2	1.2287		2.3303	1.4645	3.1917	2.0722	2.6791	2.6791	2.1199	2.1199
C3	1.4645	2.3303		2.6742	1.0834	3.7417	1.0911	1.0911	2.6517	2.6517
C4	2.3303	1.4645	2.6742		3.7417	1.0834	2.6517	2.6517	1.0911	1.0911
H5	2.0722	3.1917	1.0834	3.7417		4.7963	1.7732	1.7732	3.6906	3.6906
H6	3.1917	2.0722	3.7417	1.0834	4.7963		3.6906	3.6906	1.7732	1.7732
H7	2.1199	2.6791	1.0911	2.6517	1.7732	3.6906		1.7637	2.8075	2.1843
H8	2.1199	2.6791	1.0911	2.6517	1.7732	3.6906	1.7637		2.1843	2.8075
H9	2.6791	2.1199	2.6517	1.0911	3.6906	1.7732	2.8075	2.1843		1.7637
H10	2.6791	2.1199	2.6517	1.0911	3.6906	1.7732	2.1843	2.8075	1.7637

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	C4	119.574	N1	C3	H5	107.903
N1	C3	H7	111.260	N1	C3	H8	111.260
N2	N1	C3	119.574	N2	C4	H6	107.903
N2	C4	H9	111.260	N2	C4	H10	111.260
H5	C3	H7	109.269	H5	C3	H8	109.269
H6	C4	H9	109.269	H6	C4	H10	109.269
H7	C3	H8	107.853	H9	C4	H10	107.853

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

using model chemistry: B1B95/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	-0.092
2	N	-0.092
3	C	-0.271
4	C	-0.271
5	H	0.133
6	H	0.133
7	H	0.115
8	H	0.115
9	H	0.115
10	H	0.115

<r²>	78.405
(<r²>)^1/2	8.855

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

using model chemistry: B1B95/cc-pVTZ

States and conformations

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