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	hartrees
Energy at 0K	-188.175485
Energy at 298.15K	-188.182891
HF Energy	-188.175485
Nuclear repulsion energy	119.285986

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3079	3016	0.00
2	A_g	2969	2908	0.00
3	A_g	1579	1547	0.00
4	A_g	1438	1409	0.00
5	A_g	1375	1347	0.00
6	A_g	1181	1157	0.00
7	A_g	907	889	0.00
8	A_g	589	577	0.00
9	A_u	3079	3016	9.52
10	A_u	1447	1418	29.75
11	A_u	1117	1094	0.91
12	A_u	287	282	9.72
13	A_u	176	173	7.11
14	B_g	3079	3016	0.00
15	B_g	1446	1417	0.00
16	B_g	1023	1003	0.00
17	B_g	245	240	0.00
18	B_u	3078	3015	26.32
19	B_u	2966	2906	40.17
20	B_u	1450	1420	46.18
21	B_u	1384	1356	22.42
22	B_u	1122	1099	4.22
23	B_u	1042	1021	10.78
24	B_u	335	329	19.49

Atom	x (Å)	y (Å)	z (Å)
N1	0.371	0.512	0.000
N2	-0.371	-0.512	0.000
C3	-0.371	1.761	0.000
C4	0.371	-1.761	0.000
H5	-1.465	1.597	0.000
H6	1.465	-1.597	0.000
H7	-0.066	2.344	0.887
H8	-0.066	2.344	-0.887
H9	0.066	-2.344	0.887
H10	0.066	-2.344	-0.887

	N1	N2	C3	C4	H5	H6	H7	H8	H9	H10
N1		1.2647	1.4538	2.2732	2.1331	2.3753	2.0820	2.0820	3.0057	3.0057
N2	1.2647		2.2732	1.4538	2.3753	2.1331	3.0057	3.0057	2.0820	2.0820
C3	1.4538	2.2732		3.6003	1.1059	3.8276	1.1040	1.1040	4.2228	4.2228
C4	2.2732	1.4538	3.6003		3.8276	1.1059	4.2228	4.2228	1.1040	1.1040
H5	2.1331	2.3753	1.1059	3.8276		4.3342	1.8168	1.8168	4.3198	4.3198
H6	2.3753	2.1331	3.8276	1.1059	4.3342		4.3198	4.3198	1.8168	1.8168
H7	2.0820	3.0057	1.1040	4.2228	1.8168	4.3198		1.7735	4.6897	5.0138
H8	2.0820	3.0057	1.1040	4.2228	1.8168	4.3198	1.7735		5.0138	4.6897
H9	3.0057	2.0820	4.2228	1.1040	4.3198	1.8168	4.6897	5.0138		1.7735
H10	3.0057	2.0820	4.2228	1.1040	4.3198	1.8168	5.0138	4.6897	1.7735

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	C4	113.295	N1	C3	H5	112.170
N1	C3	H7	108.199	N1	C3	H8	108.199
N2	N1	C3	113.295	N2	C4	H6	112.170
N2	C4	H9	108.199	N2	C4	H10	108.199
H5	C3	H7	110.598	H5	C3	H8	110.598
H6	C4	H9	110.598	H6	C4	H10	110.598
H7	C3	H8	106.887	H9	C4	H10	106.887

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

using model chemistry: LSDA/6-31G

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	-0.178
2	N	-0.178
3	C	-0.407
4	C	-0.407
5	H	0.180
6	H	0.180
7	H	0.203
8	H	0.203
9	H	0.203
10	H	0.203

	x	y	z
x	4.681	-0.290	0.000
y	-0.290	8.470	0.000
z	0.000	0.000	3.985

<r²>	93.902
(<r²>)^1/2	9.690

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

using model chemistry: LSDA/6-31G

States and conformations

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