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	hartrees
Energy at 0K	-189.156839
Energy at 298.15K	-189.164158
HF Energy	-189.156839
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3069	3009	0.00
2	A_g	2976	2917	0.00
3	A_g	1611	1580	0.00
4	A_g	1467	1438	0.00
5	A_g	1391	1364	0.00
6	A_g	1187	1164	0.00
7	A_g	899	881	0.00
8	A_g	581	570	0.00
9	A_u	3060	3000	38.33
10	A_u	1471	1442	11.79
11	A_u	1120	1098	0.39
12	A_u	280	274	6.66
13	A_u	157	154	3.29
14	B_g	3061	3001	0.00
15	B_g	1469	1441	0.00
16	B_g	1018	998	0.00
17	B_g	223	218	0.00
18	B_u	3069	3009	50.75
19	B_u	2973	2915	63.50
20	B_u	1475	1446	22.74
21	B_u	1397	1370	0.93
22	B_u	1126	1103	0.43
23	B_u	979	960	9.79
24	B_u	343	336	14.18

Atom	x (Å)	y (Å)	z (Å)
N1	0.378	0.499	0.000
N2	-0.378	-0.499	0.000
C3	-0.378	1.764	0.000
C4	0.378	-1.764	0.000
H5	-1.468	1.608	0.000
H6	1.468	-1.608	0.000
H7	-0.068	2.339	0.886
H8	-0.068	2.339	-0.886
H9	0.068	-2.339	0.886
H10	0.068	-2.339	-0.886

	N1	N2	C3	C4	H5	H6	H7	H8	H9	H10
N1		1.2521	1.4732	2.2633	2.1530	2.3729	2.0901	2.0901	2.9894	2.9894
N2	1.2521		2.2633	1.4732	2.3729	2.1530	2.9894	2.9894	2.0901	2.0901
C3	1.4732	2.2633		3.6080	1.1008	3.8443	1.1006	1.1006	4.2212	4.2212
C4	2.2633	1.4732	3.6080		3.8443	1.1008	4.2212	4.2212	1.1006	1.1006
H5	2.1530	2.3729	1.1008	3.8443		4.3547	1.8101	1.8101	4.3274	4.3274
H6	2.3729	2.1530	3.8443	1.1008	4.3547		4.3274	4.3274	1.8101	1.8101
H7	2.0901	2.9894	1.1006	4.2212	1.8101	4.3274		1.7721	4.6800	5.0042
H8	2.0901	2.9894	1.1006	4.2212	1.8101	4.3274	1.7721		5.0042	4.6800
H9	2.9894	2.0901	4.2212	1.1006	4.3274	1.8101	4.6800	5.0042		1.7721
H10	2.9894	2.0901	4.2212	1.1006	4.3274	1.8101	5.0042	4.6800	1.7721

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	C4	113.101	N1	C3	H5	112.826
N1	C3	H7	107.832	N1	C3	H8	107.832
N2	N1	C3	113.101	N2	C4	H6	112.826
N2	C4	H9	107.832	N2	C4	H10	107.832
H5	C3	H7	110.447	H5	C3	H8	110.447
H6	C4	H9	110.447	H6	C4	H10	110.447
H7	C3	H8	107.247	H9	C4	H10	107.247

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

using model chemistry: B97D3/6-31G*

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	-0.176
2	N	-0.176
3	C	-0.324
4	C	-0.324
5	H	0.159
6	H	0.159
7	H	0.171
8	H	0.171
9	H	0.171
10	H	0.171

	x	y	z
x	4.715	-0.300	0.000
y	-0.300	8.409	0.000
z	0.000	0.000	4.078

<r²>	93.940
(<r²>)^1/2	9.692

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

using model chemistry: B97D3/6-31G*

States and conformations

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