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	hartrees
Energy at 0K	-338.014010
Energy at 298.15K	-338.022847
Nuclear repulsion energy	261.225590

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3135	3097	0.00
2	A_g	2985	2948	0.00
3	A_g	1574	1555	0.00
4	A_g	1396	1379	0.00
5	A_g	1386	1369	0.00
6	A_g	1329	1313	0.00
7	A_g	1055	1042	0.00
8	A_g	796	786	0.00
9	A_g	633	625	0.00
10	A_g	402	397	0.00
11	A_u	3055	3018	2.50
12	A_u	1378	1361	37.28
13	A_u	1074	1061	1.55
14	A_u	315	311	5.63
15	A_u	191	189	13.00
16	A_u	76	75	0.86
17	B_g	3055	3018	0.00
18	B_g	1374	1357	0.00
19	B_g	1050	1037	0.00
20	B_g	502	496	0.00
21	B_g	115	114	0.00
22	B_u	3136	3098	2.00
23	B_u	2985	2949	5.56
24	B_u	1454	1436	162.33
25	B_u	1386	1369	136.93
26	B_u	1336	1319	51.16
27	B_u	1145	1131	3.60
28	B_u	943	931	31.70
29	B_u	549	543	30.56
30	B_u	293	289	24.38

Atom	x (Å)	y (Å)	z (Å)
N1	-0.065	0.654	0.000
N2	0.065	-0.654	0.000
O3	-1.187	1.204	0.000
O4	1.187	-1.204	0.000
C5	1.187	1.377	0.000
C6	-1.187	-1.377	0.000
H7	0.918	2.438	0.000
H8	1.777	1.095	0.886
H9	1.777	1.095	-0.886
H10	-0.918	-2.438	0.000
H11	-1.777	-1.095	0.886
H12	-1.777	-1.095	-0.886

	N1	N2	O3	O4	C5	C6	H7	H8	H9	H10	H11	H12
N1		1.3152	1.2498	2.2409	1.4460	2.3211	2.0365	2.0907	2.0907	3.2078	2.6032	2.6032
N2	1.3152		2.2409	1.2498	2.3211	1.4460	3.2078	2.6032	2.6032	2.0365	2.0907	2.0907
O3	1.2498	2.2409		3.3820	2.3813	2.5811	2.4407	3.0957	3.0957	3.6516	2.5334	2.5334
O4	2.2409	1.2498	3.3820		2.5811	2.3813	3.6516	2.5334	2.5334	2.4407	3.0957	3.0957
C5	1.4460	2.3211	2.3813	2.5811		3.6369	1.0942	1.1011	1.1011	4.3576	3.9603	3.9603
C6	2.3211	1.4460	2.5811	2.3813	3.6369		4.3576	3.9603	3.9603	1.0942	1.1011	1.1011
H7	2.0365	3.2078	2.4407	3.6516	1.0942	4.3576		1.8234	1.8234	5.2100	4.5310	4.5310
H8	2.0907	2.6032	3.0957	2.5334	1.1011	3.9603	1.8234		1.7728	4.5310	4.1740	4.5349
H9	2.0907	2.6032	3.0957	2.5334	1.1011	3.9603	1.8234	1.7728		4.5310	4.5349	4.1740
H10	3.2078	2.0365	3.6516	2.4407	4.3576	1.0942	5.2100	4.5310	4.5310		1.8234	1.8234
H11	2.6032	2.0907	2.5334	3.0957	3.9603	1.1011	4.5310	4.1740	4.5349	1.8234		1.7728
H12	2.6032	2.0907	2.5334	3.0957	3.9603	1.1011	4.5310	4.5349	4.1740	1.8234	1.7728

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	O4	121.746	N1	N2	C6	114.327
N1	C5	H7	105.754	N1	C5	H8	109.593
N1	C5	H9	109.593	N2	N1	O3	121.746
N2	N1	C5	114.327	N2	C6	H10	105.754
N2	C6	H11	109.593	N2	C6	H12	109.593
O3	N1	C5	123.927	O4	N2	C6	123.927
H7	C5	H8	112.328	H7	C5	H9	112.328
H8	C5	H9	107.229	H10	C6	H11	112.328
H10	C6	H12	112.328	H11	C6	H12	107.229

All results from a given calculation for C₂H₆N₂O₂ ((E)-Azodioxymethane)

using model chemistry: LSDA/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	0.056
2	N	0.056
3	O	-0.348
4	O	-0.348
5	C	-0.265
6	C	-0.265
7	H	0.176
8	H	0.191
9	H	0.191
10	H	0.176
11	H	0.191
12	H	0.191

	x	y	z
x	8.213	-0.288	0.000
y	-0.288	9.220	0.000
z	0.000	0.000	4.737

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for C2H6N2O2 ((E)-Azodioxymethane)

using model chemistry: LSDA/6-311G**

States and conformations

All results from a given calculation for C₂H₆N₂O₂ ((E)-Azodioxymethane)