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	hartrees
Energy at 0K	-339.612939
Energy at 298.15K	-339.622142
Nuclear repulsion energy	262.129863

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3196	3064	6.79
2	A	3193	3061	2.53
3	A	3148	3017	36.89
4	A	3143	3013	0.19
5	A	3046	2920	49.94
6	A	3040	2914	24.91
7	A	1682	1612	321.46
8	A	1533	1469	54.06
9	A	1512	1450	0.59
10	A	1512	1449	23.95
11	A	1492	1430	10.47
12	A	1486	1425	56.18
13	A	1442	1383	10.20
14	A	1372	1315	272.95
15	A	1346	1290	1.49
16	A	1284	1230	8.62
17	A	1160	1112	45.11
18	A	1133	1086	2.00
19	A	1064	1020	11.64
20	A	1025	983	69.31
21	A	882	845	11.07
22	A	798	765	18.87
23	A	635	608	1.24
24	A	627	601	9.73
25	A	422	405	3.46
26	A	364	349	2.05
27	A	215	206	7.18
28	A	164	157	0.65
29	A	150	144	5.20
30	A	128	123	0.00

Atom	x (Å)	y (Å)	z (Å)
O1	-1.346	-1.085	0.032
O2	-1.346	1.085	0.032
H3	1.190	-1.521	1.112
H4	2.266	-1.151	-0.259
H5	0.763	-2.050	-0.525
C6	1.229	-1.256	0.050
H7	1.190	1.521	1.112
H8	0.762	2.050	-0.524
H9	2.266	1.151	-0.259
C10	1.228	1.256	0.050
N11	-0.798	-0.000	-0.030
N12	0.563	-0.000	-0.224

	O1	O2	H3	H4	H5	C6	H7	H8	H9	C10	N11	N12
O1		2.1702	2.7904	3.6241	2.3843	2.5799	3.7932	3.8185	4.2580	3.4793	1.2170	2.2102
O2	2.1702		3.7932	4.2579	3.8186	3.4793	2.7903	2.3840	3.6239	2.5797	1.2170	2.2101
H3	2.7904	3.7932		1.7814	1.7718	1.0948	3.0423	3.9511	3.1904	2.9730	2.7515	2.1191
H4	3.6241	4.2579	1.7814		1.7715	1.0877	3.1903	3.5465	2.3025	2.6392	3.2813	2.0562
H5	2.3843	3.8186	1.7718	1.7715		1.0854	3.9511	4.0995	3.5464	3.3872	2.6233	2.0813
C6	2.5799	3.4793	1.0948	1.0877	1.0854		2.9730	3.3872	2.6392	2.5113	2.3854	1.4474
H7	3.7932	2.7903	3.0423	3.1903	3.9511	2.9730		1.7718	1.7814	1.0948	2.7515	2.1191
H8	3.8185	2.3840	3.9511	3.5465	4.0995	3.3872	1.7718		1.7715	1.0854	2.6232	2.0813
H9	4.2580	3.6239	3.1904	2.3025	3.5464	2.6392	1.7814	1.7715		1.0877	3.2812	2.0562
C10	3.4793	2.5797	2.9730	2.6392	3.3872	2.5113	1.0948	1.0854	1.0877		2.3854	1.4474
N11	1.2170	1.2170	2.7515	3.2813	2.6233	2.3854	2.7515	2.6232	3.2812	2.3854		1.3745
N12	2.2102	2.2101	2.1191	2.0562	2.0813	1.4474	2.1191	2.0813	2.0562	1.4474	1.3745

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	N11	O2	126.154	O1	N11	N12	116.914
O2	N11	N12	116.909	H3	C6	H4	109.416
H3	C6	H5	108.720	H3	C6	N12	112.196
H4	C6	H5	109.216	H4	C6	N12	107.555
H5	C6	N12	109.697	C6	N12	C10	120.349
C6	N12	N11	115.388	H7	C10	H8	108.720
H7	C10	H9	109.416	H7	C10	N12	112.196
H8	C10	H9	109.216	H8	C10	N12	109.696
H9	C10	N12	107.555	C10	N12	N11	115.384

All results from a given calculation for C₂H₆N₂O₂ (Dimethylnitroamine)

using model chemistry: B1B95/6-311G*

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	O	-0.308
2	O	-0.308
3	H	0.237
4	H	0.230
5	H	0.268
6	C	-0.522
7	H	0.237
8	H	0.268
9	H	0.230
10	C	-0.522
11	N	0.409
12	N	-0.221

	x	y	z	Total
	4.487	0.000	0.152	4.489
CHELPG
AIM
ESP

	x	y	z
x	7.686	0.000	-0.040
y	0.000	7.727	0.000
z	-0.040	0.000	4.602

<r²>	147.546
(<r²>)^1/2	12.147

All results from a given calculation for C2H6N2O2 (Dimethylnitroamine)

using model chemistry: B1B95/6-311G*

States and conformations

All results from a given calculation for C₂H₆N₂O₂ (Dimethylnitroamine)