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	hartrees
Energy at 0K	-336.741902
Energy at 298.15K	-336.748589
Nuclear repulsion energy	235.804873

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3987	3599	0.00
2	A_g	3842	3468	0.00
3	A_g	2007	1811	0.00
4	A_g	1776	1603	0.00
5	A_g	1570	1417	0.00
6	A_g	1218	1099	0.00
7	A_g	845	763	0.00
8	A_g	582	525	0.00
9	A_g	441	398	0.00
10	A_u	710	641	19.90
11	A_u	533	482	316.48
12	A_u	391	353	353.53
13	A_u	86	78	4.98
14	B_g	909	821	0.00
15	B_g	681	614	0.00
16	B_g	405	366	0.00
17	B_u	3988	3599	220.29
18	B_u	3842	3468	175.79
19	B_u	1963	1772	901.04
20	B_u	1757	1586	365.25
21	B_u	1425	1286	254.08
22	B_u	1201	1084	2.39
23	B_u	634	572	42.27
24	B_u	307	277	39.54

Atom	x (Å)	y (Å)
C1	0.000	0.769
C2	0.000	-0.769
O3	1.029	1.386
O4	-1.029	-1.386
N5	-1.229	1.286
N6	1.229	-1.286
H7	-1.342	2.273
H8	-2.015	0.680
H9	1.342	-2.273
H10	2.015	-0.680

	C1	C2	O3	O4	N5	N6	H7	H8	H9	H10
C1		1.5389	1.1998	2.3884	1.3328	2.3949	2.0149	2.0171	3.3248	2.4821
C2	1.5389		2.3884	1.1998	2.3949	1.3328	3.3248	2.4821	2.0149	2.0171
O3	1.1998	2.3884		3.4525	2.2601	2.6795	2.5317	3.1254	3.6716	2.2886
O4	2.3884	1.1998	3.4525		2.6795	2.2601	3.6716	2.2886	2.5317	3.1254
N5	1.3328	2.3949	2.2601	2.6795		3.5575	0.9927	0.9934	4.3900	3.7929
N6	2.3949	1.3328	2.6795	2.2601	3.5575		4.3900	3.7929	0.9927	0.9934
H7	2.0149	3.3248	2.5317	3.6716	0.9927	4.3900		1.7293	5.2782	4.4704
H8	2.0171	2.4821	3.1254	2.2886	0.9934	3.7929	1.7293		4.4704	4.2533
H9	3.3248	2.0149	3.6716	2.5317	4.3900	0.9927	5.2782	4.4704		1.7293
H10	2.4821	2.0171	2.2886	3.1254	3.7929	0.9934	4.4704	4.2533	1.7293

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O4	120.908	C1	C2	N6	112.818
C1	N5	H7	119.374	C1	N5	H8	119.542
C2	C1	O3	120.908	C2	C1	N5	112.818
C2	N6	H9	119.374	C2	N6	H10	119.542
O3	C1	N5	126.275	O4	C2	N6	126.275
H7	N5	H8	121.084	H9	N6	H10	121.084

All results from a given calculation for C₂H₄N₂O₂ (Oxalamide)

using model chemistry: HF/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	CHELPG
1	C	0.678	0.756
2	C	0.678	0.756
3	O	-0.611	-0.617
4	O	-0.611	-0.617
5	N	-0.744	-1.026
6	N	-0.744	-1.026
7	H	0.327	0.466
8	H	0.350	0.421
9	H	0.327	0.466
10	H	0.350	0.421

	x	y	z
x	6.813	-0.098	0.000
y	-0.098	5.403	0.000
z	0.000	0.000	2.546

<r²>	142.563
(<r²>)^1/2	11.940

All results from a given calculation for C2H4N2O2 (Oxalamide)

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

States and conformations

All results from a given calculation for C₂H₄N₂O₂ (Oxalamide)