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	hartrees
Energy at 0K	-339.299483
Energy at 298.15K	-339.308322
Nuclear repulsion energy	258.334156

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3127	3085	1.64
2	A	3126	3083	0.85
3	A	3065	3023	30.21
4	A	3062	3020	0.16
5	A	2963	2922	52.60
6	A	2957	2917	23.43
7	A	1614	1591	224.28
8	A	1478	1458	32.18
9	A	1458	1438	0.15
10	A	1458	1438	9.85
11	A	1437	1417	15.36
12	A	1423	1403	51.65
13	A	1382	1364	13.43
14	A	1297	1279	222.15
15	A	1287	1269	1.43
16	A	1234	1217	3.46
17	A	1115	1100	43.12
18	A	1086	1071	2.51
19	A	1023	1009	6.60
20	A	957	944	79.41
21	A	836	824	16.70
22	A	742	732	14.55
23	A	596	588	0.91
24	A	595	587	7.42
25	A	405	399	3.92
26	A	354	349	2.22
27	A	201	198	10.75
28	A	135	133	0.18
29	A	115	114	1.23
30	A	86	84	0.05

Atom	x (Å)	y (Å)	z (Å)
O1	-1.370	-1.107	0.033
O2	-1.370	1.107	0.033
H3	1.310	-1.469	1.138
H4	2.269	-1.191	-0.357
H5	0.712	-2.078	-0.438
C6	1.251	-1.258	0.052
H7	1.309	1.469	1.138
H8	0.712	2.078	-0.438
H9	2.268	1.192	-0.357
C10	1.250	1.259	0.053
N11	-0.815	-0.000	-0.028
N12	0.576	-0.000	-0.236

	O1	O2	H3	H4	H5	C6	H7	H8	H9	C10	N11	N12
O1		2.2141	2.9207	3.6606	2.3452	2.6249	3.8773	3.8337	4.3215	3.5301	1.2399	2.2550
O2	2.2141		3.8773	4.3213	3.8340	3.5301	2.9203	2.3443	3.6600	2.6243	1.2399	2.2548
H3	2.9207	3.8773		1.7976	1.7916	1.1071	2.9377	3.9266	3.1990	2.9360	2.8333	2.1411
H4	3.6606	4.3213	1.7976		1.7931	1.0996	3.1988	3.6220	2.3832	2.6847	3.3220	2.0735
H5	2.3452	3.8340	1.7916	1.7931		1.0961	3.9265	4.1556	3.6220	3.4148	2.6109	2.0919
C6	2.6249	3.5301	1.1071	1.0996	1.0961		2.9359	3.4148	2.6847	2.5170	2.4197	1.4567
H7	3.8773	2.9203	2.9377	3.1988	3.9265	2.9359		1.7916	1.7977	1.1071	2.8332	2.1410
H8	3.8337	2.3443	3.9266	3.6220	4.1556	3.4148	1.7916		1.7931	1.0961	2.6105	2.0919
H9	4.3215	3.6600	3.1990	2.3832	3.6220	2.6847	1.7977	1.7931		1.0996	3.3219	2.0735
C10	3.5301	2.6243	2.9360	2.6847	3.4148	2.5170	1.1071	1.0961	1.0996		2.4195	1.4567
N11	1.2399	1.2399	2.8333	3.3220	2.6109	2.4197	2.8332	2.6105	3.3219	2.4195		1.4063
N12	2.2550	2.2548	2.1411	2.0735	2.0919	1.4567	2.1410	2.0919	2.0735	1.4567	1.4063

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	N11	O2	126.457	O1	N11	N12	116.756
O2	N11	N12	116.741	H3	C6	H4	109.103
H3	C6	H5	108.819	H3	C6	N12	112.541
H4	C6	H5	109.501	H4	C6	N12	107.591
H5	C6	N12	109.247	C6	N12	C10	119.520
C6	N12	N11	115.364	H7	C10	H8	108.819
H7	C10	H9	109.104	H7	C10	N12	112.542
H8	C10	H9	109.501	H8	C10	N12	109.245
H9	C10	N12	107.592	C10	N12	N11	115.352

All results from a given calculation for C₂H₆N₂O₂ (Dimethylnitroamine)

using model chemistry: PBEPBE/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	O	-0.394
2	O	-0.394
3	H	0.142
4	H	0.139
5	H	0.178
6	C	-0.229
7	H	0.142
8	H	0.178
9	H	0.139
10	C	-0.229
11	N	0.589
12	N	-0.262

	x	y	z	Total
	4.204	0.000	0.185	4.208
CHELPG
AIM
ESP

	x	y	z
x	8.167	0.000	-0.036
y	0.000	7.763	0.000
z	-0.036	0.000	4.577

<r²>	150.771
(<r²>)^1/2	12.279

All results from a given calculation for C2H6N2O2 (Dimethylnitroamine)

using model chemistry: PBEPBE/6-31G**

States and conformations

All results from a given calculation for C₂H₆N₂O₂ (Dimethylnitroamine)