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	hartrees
Energy at 0K	-338.233884
Energy at 298.15K	-338.239977
Nuclear repulsion energy	231.627157

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3634	3582	0.00
2	A_g	3488	3438	0.00
3	A_g	1776	1751	0.00
4	A_g	1546	1524	0.00
5	A_g	1373	1354	0.00
6	A_g	1072	1056	0.00
7	A_g	748	737	0.00
8	A_g	514	507	0.00
9	A_g	381	376	0.00
10	A_u	683	673	0.00
11	A_u	461	454	167.62
12	A_u	312	308	346.79
13	A_u	95	94	0.11
14	B_g	786	774	0.00
15	B_g	669	659	0.00
16	B_g	314	309	0.00
17	B_u	3635	3583	140.00
18	B_u	3487	3438	92.92
19	B_u	1749	1724	476.56
20	B_u	1553	1530	333.88
21	B_u	1286	1267	88.84
22	B_u	1067	1051	14.20
23	B_u	550	542	16.81
24	B_u	267	264	40.24

Atom	x (Å)	y (Å)
C1	-0.063	0.773
C2	0.063	-0.773
O3	-1.159	1.347
O4	1.159	-1.347
N5	1.159	1.357
N6	-1.159	-1.357
H7	1.252	2.369
H8	1.975	0.745
H9	-1.252	-2.369
H10	-1.975	-0.745

	C1	C2	O3	O4	N5	N6	H7	H8	H9	H10
C1		1.5513	1.2366	2.4470	1.3547	2.3954	2.0679	2.0390	3.3592	2.4416
C2	1.5513		2.4470	1.2366	2.3954	1.3547	3.3592	2.4416	2.0679	2.0390
O3	1.2366	2.4470		3.5535	2.3178	2.7040	2.6182	3.1915	3.7169	2.2459
O4	2.4470	1.2366	3.5535		2.7040	2.3178	3.7169	2.2459	2.6182	3.1915
N5	1.3547	2.3954	2.3178	2.7040		3.5693	1.0161	1.0203	4.4379	3.7742
N6	2.3954	1.3547	2.7040	2.3178	3.5693		4.4379	3.7742	1.0161	1.0203
H7	2.0679	3.3592	2.6182	3.7169	1.0161	4.4379		1.7777	5.3586	4.4847
H8	2.0390	2.4416	3.1915	2.2459	1.0203	3.7742	1.7777		4.4847	4.2227
H9	3.3592	2.0679	3.7169	2.6182	4.4379	1.0161	5.3586	4.4847		1.7777
H10	2.4416	2.0390	2.2459	3.1915	3.7742	1.0203	4.4847	4.2227	1.7777

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O4	122.330	C1	C2	N6	110.853
C1	N5	H7	120.776	C1	N5	H8	117.615
C2	C1	O3	122.330	C2	C1	N5	110.853
C2	N6	H9	120.776	C2	N6	H10	117.615
O3	C1	N5	126.816	O4	C2	N6	126.816
H7	N5	H8	121.609	H9	N6	H10	121.609

All results from a given calculation for C₂H₄N₂O₂ (Oxalamide)

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	C	0.502
2	C	0.502
3	O	-0.493
4	O	-0.493
5	N	-0.719
6	N	-0.719
7	H	0.346
8	H	0.364
9	H	0.346
10	H	0.364

	x	y	z
x	7.860	0.631	0.000
y	0.631	6.665	0.000
z	0.000	0.000	2.614

<r²>	145.597
(<r²>)^1/2	12.066

All results from a given calculation for C2H4N2O2 (Oxalamide)

using model chemistry: PBEPBE/6-31G*

States and conformations

All results from a given calculation for C₂H₄N₂O₂ (Oxalamide)