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	hartrees
Energy at 0K	-63.939487
Energy at 298.15K	-63.946540
Nuclear repulsion energy	125.476471

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3995	3601	0.00
2	A_g	3837	3459	0.00
3	A_g	1868	1684	0.00
4	A_g	1788	1612	0.00
5	A_g	1586	1429	0.00
6	A_g	1229	1108	0.00
7	A_g	839	756	0.00
8	A_g	578	521	0.00
9	A_g	430	388	0.00
10	A_u	786	708	974.75
11	A_u	681	614	2.10
12	A_u	467	421	8.87
13	A_u	97	88	24.08
14	B_g	903	814	0.00
15	B_g	749	675	0.00
16	B_g	655	590	0.00
17	B_u	3996	3602	199.54
18	B_u	3837	3459	201.01
19	B_u	1808	1630	1006.12
20	B_u	1788	1612	259.54
21	B_u	1427	1286	318.11
22	B_u	1212	1092	0.27
23	B_u	621	560	44.36
24	B_u	290	261	43.53

Atom	x (Å)	y (Å)
C1	0.000	0.772
C2	0.000	-0.772
O3	1.071	1.396
O4	-1.071	-1.396
N5	-1.235	1.323
N6	1.235	-1.323
H7	-1.327	2.317
H8	-2.044	0.737
H9	1.327	-2.317
H10	2.044	-0.737

	C1	C2	O3	O4	N5	N6	H7	H8	H9	H10
C1		1.5444	1.2400	2.4189	1.3524	2.4325	2.0362	2.0441	3.3619	2.5408
C2	1.5444		2.4189	1.2400	2.4325	1.3524	3.3619	2.5408	2.0362	2.0441
O3	1.2400	2.4189		3.5202	2.3076	2.7247	2.5689	3.1842	3.7219	2.3448
O4	2.4189	1.2400	3.5202		2.7247	2.3076	3.7219	2.3448	2.5689	3.1842
N5	1.3524	2.4325	2.3076	2.7247		3.6203	0.9976	0.9988	4.4513	3.8726
N6	2.4325	1.3524	2.7247	2.3076	3.6203		4.4513	3.8726	0.9976	0.9988
H7	2.0362	3.3619	2.5689	3.7219	0.9976	4.4513		1.7345	5.3396	4.5484
H8	2.0441	2.5408	3.1842	2.3448	0.9988	3.8726	1.7345		4.5484	4.3454
H9	3.3619	2.0362	3.7219	2.5689	4.4513	0.9976	5.3396	4.5484		1.7345
H10	2.5408	2.0441	2.3448	3.1842	3.8726	0.9988	4.5484	4.3454	1.7345

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O4	120.224	C1	C2	N6	114.051
C1	N5	H7	119.337	C1	N5	H8	120.018
C2	C1	O3	120.224	C2	C1	N5	114.051
C2	N6	H9	119.337	C2	N6	H10	120.018
O3	C1	N5	125.725	O4	C2	N6	125.725
H7	N5	H8	120.645	H9	N6	H10	120.645

All results from a given calculation for C₂H₄N₂O₂ (Oxalamide)

using model chemistry: HF/CEP-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	C	0.017
2	C	0.017
3	O	-0.276
4	O	-0.276
5	N	-0.543
6	N	-0.543
7	H	0.380
8	H	0.421
9	H	0.380
10	H	0.421

	x	y	z
x	5.380	-0.516	-0.001
y	-0.516	7.214	-0.001
z	-0.001	-0.001	2.877

<r²>	120.007
(<r²>)^1/2	10.955

All results from a given calculation for C2H4N2O2 (Oxalamide)

using model chemistry: HF/CEP-31G

States and conformations

All results from a given calculation for C₂H₄N₂O₂ (Oxalamide)