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	hartrees
Energy at 0K	-339.709870
Energy at 298.15K	-339.718723
Nuclear repulsion energy	257.223001

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3085	3076	2.78
2	A	3083	3074	2.74
3	A	3034	3025	35.28
4	A	3028	3019	0.53
5	A	2936	2927	59.48
6	A	2931	2922	26.74
7	A	1498	1494	228.70
8	A	1480	1476	23.82
9	A	1460	1455	16.88
10	A	1458	1453	9.02
11	A	1440	1436	13.92
12	A	1430	1426	16.42
13	A	1397	1392	17.46
14	A	1238	1235	0.07
15	A	1231	1227	191.85
16	A	1220	1217	34.39
17	A	1113	1109	76.78
18	A	1090	1087	2.02
19	A	1016	1013	9.20
20	A	916	914	94.53
21	A	810	808	12.95
22	A	733	731	13.28
23	A	580	579	9.84
24	A	572	570	2.82
25	A	399	398	2.45
26	A	341	340	1.60
27	A	198	197	10.74
28	A	134	133	2.29
29	A	133	133	0.26
30	A	103	103	0.02

Atom	x (Å)	y (Å)	z (Å)
O1	1.381	1.107	0.033
O2	1.381	-1.107	0.033
H3	-1.286	1.492	1.130
H4	-2.285	1.178	-0.322
H5	-0.755	2.082	-0.466
C6	-1.261	1.267	0.052
H7	-1.288	-1.491	1.130
H8	-0.755	-2.082	-0.465
H9	-2.285	-1.179	-0.323
C10	-1.261	-1.267	0.052
N11	0.821	-0.000	-0.027
N12	-0.579	-0.000	-0.235

	O1	O2	H3	H4	H5	C6	H7	H8	H9	C10	N11	N12
O1		2.2141	2.9096	3.6840	2.4004	2.6470	3.8829	3.8701	4.3347	3.5521	1.2418	2.2665
O2	2.2141		3.8826	4.3347	3.8705	3.5521	2.9109	2.3997	3.6840	2.6472	1.2418	2.2665
H3	2.9096	3.8826		1.7899	1.7826	1.1013	2.9838	3.9501	3.2002	2.9624	2.8300	2.1426
H4	3.6840	4.3347	1.7899		1.7832	1.0939	3.1984	3.6047	2.3567	2.6772	3.3358	2.0757
H5	2.4004	3.8705	1.7826	1.7832		1.0904	3.9499	4.1641	3.6045	3.4265	2.6482	2.1022
C6	2.6470	3.5521	1.1013	1.0939	1.0904		2.9618	3.4266	2.6777	2.5341	2.4391	1.4676
H7	3.8829	2.9109	2.9838	3.1984	3.9499	2.9618		1.7827	1.7899	1.1013	2.8306	2.1426
H8	3.8701	2.3997	3.9501	3.6047	4.1641	3.4266	1.7827		1.7832	1.0904	2.6477	2.1021
H9	4.3347	3.6840	3.2002	2.3567	3.6045	2.6777	1.7899	1.7832		1.0939	3.3357	2.0758
C10	3.5521	2.6472	2.9624	2.6772	3.4265	2.5341	1.1013	1.0904	1.0939		2.4392	1.4676
N11	1.2418	1.2418	2.8300	3.3358	2.6482	2.4391	2.8306	2.6477	3.3357	2.4392		1.4154
N12	2.2665	2.2665	2.1426	2.0757	2.1022	1.4676	2.1426	2.1021	2.0758	1.4676	1.4154

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	N11	O2	126.116	O1	N11	N12	116.917
O2	N11	N12	116.921	H3	C6	H4	109.246
H3	C6	H5	108.847	H3	C6	N12	112.246
H4	C6	H5	109.447	H4	C6	N12	107.363
H5	C6	N12	109.653	C6	N12	C10	119.388
C6	N12	N11	115.554	H7	C10	H8	108.849
H7	C10	H9	109.246	H7	C10	N12	112.246
H8	C10	H9	109.448	H8	C10	N12	109.649
H9	C10	N12	107.366	C10	N12	N11	115.559

All results from a given calculation for C₂H₆N₂O₂ (Dimethylnitroamine)

using model chemistry: BLYP/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	O	-0.281
2	O	-0.281
3	H	0.089
4	H	0.090
5	H	0.123
6	C	-0.159
7	H	0.089
8	H	0.123
9	H	0.090
10	C	-0.159
11	N	0.351
12	N	-0.075

	x	y	z	Total
	-4.359	0.000	0.125	4.361
CHELPG
AIM
ESP

	x	y	z
x	0.000	0.000	0.000
y	0.000	0.000	0.000
z	0.000	0.000	0.000

<r²>	152.734
(<r²>)^1/2	12.359

All results from a given calculation for C2H6N2O2 (Dimethylnitroamine)

using model chemistry: BLYP/cc-pVTZ

States and conformations

All results from a given calculation for C₂H₆N₂O₂ (Dimethylnitroamine)