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	hartrees
Energy at 0K	-336.810148
Energy at 298.15K	-336.816809
Nuclear repulsion energy	236.077812

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3990	3609	0.00
2	A_g	3854	3486	0.00
3	A_g	1990	1800	0.00
4	A_g	1801	1629	0.00
5	A_g	1565	1416	0.00
6	A_g	1224	1107	0.00
7	A_g	842	762	0.00
8	A_g	582	526	0.00
9	A_g	441	399	0.00
10	A_u	717	648	16.82
11	A_u	530	479	251.71
12	A_u	378	342	415.49
13	A_u	83	75	3.56
14	B_g	933	844	0.00
15	B_g	686	620	0.00
16	B_g	382	345	0.00
17	B_u	3991	3609	169.84
18	B_u	3854	3486	150.36
19	B_u	1944	1758	977.55
20	B_u	1789	1618	320.28
21	B_u	1418	1282	284.59
22	B_u	1205	1090	0.92
23	B_u	636	575	42.14
24	B_u	306	277	37.33

Atom	x (Å)	y (Å)
C1	0.000	0.770
C2	0.000	-0.770
O3	1.023	1.386
O4	-1.023	-1.386
N5	-1.230	1.285
N6	1.230	-1.285
H7	-1.350	2.269
H8	-2.018	0.683
H9	1.350	-2.269
H10	2.018	-0.683

	C1	C2	O3	O4	N5	N6	H7	H8	H9	H10
C1		1.5404	1.1940	2.3866	1.3337	2.3953	2.0167	2.0196	3.3251	2.4868
C2	1.5404		2.3866	1.1940	2.3953	1.3337	3.3251	2.4868	2.0167	2.0196
O3	1.1940	2.3866		3.4453	2.2556	2.6791	2.5315	3.1208	3.6692	2.2962
O4	2.3866	1.1940	3.4453		2.6791	2.2556	3.6692	2.2962	2.5315	3.1208
N5	1.3337	2.3953	2.2556	2.6791		3.5581	0.9909	0.9908	4.3914	3.7980
N6	2.3953	1.3337	2.6791	2.2556	3.5581		4.3914	3.7980	0.9909	0.9908
H7	2.0167	3.3251	2.5315	3.6692	0.9909	4.3914		1.7201	5.2795	4.4782
H8	2.0196	2.4868	3.1208	2.2962	0.9908	3.7980	1.7201		4.4782	4.2606
H9	3.3251	2.0167	3.6692	2.5315	4.3914	0.9909	5.2795	4.4782		1.7201
H10	2.4868	2.0196	2.2962	3.1208	3.7980	0.9908	4.4782	4.2606	1.7201

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O4	121.051	C1	C2	N6	112.701
C1	N5	H7	119.619	C1	N5	H8	119.920
C2	C1	O3	121.051	C2	C1	N5	112.701
C2	N6	H9	119.619	C2	N6	H10	119.920
O3	C1	N5	126.248	O4	C2	N6	126.248
H7	N5	H8	120.461	H9	N6	H10	120.461

All results from a given calculation for C₂H₄N₂O₂ (Oxalamide)

using model chemistry: HF/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	CHELPG	ESP
1	C	0.579	0.766	0.714
2	C	0.579	0.766	0.759
3	O	-0.487	-0.622	-0.596
4	O	-0.487	-0.622	-0.608
5	N	-0.903	-1.046	-1.046
6	N	-0.903	-1.046	-1.059
7	H	0.391	0.474	0.480
8	H	0.421	0.429	0.436
9	H	0.391	0.474	0.480
10	H	0.421	0.429	0.439

	x	y	z
x	6.839	-0.088	0.000
y	-0.088	5.457	0.000
z	0.000	0.000	2.914

<r²>	142.559
(<r²>)^1/2	11.940

All results from a given calculation for C2H4N2O2 (Oxalamide)

using model chemistry: HF/6-311G*

States and conformations

All results from a given calculation for C₂H₄N₂O₂ (Oxalamide)