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	hartrees
Energy at 0K	-338.633723
Energy at 298.15K	-338.640052
Nuclear repulsion energy	233.558173

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3736	3606	0.00
2	A_g	3590	3464	0.00
3	A_g	1819	1755	0.00
4	A_g	1587	1532	0.00
5	A_g	1410	1360	0.00
6	A_g	1103	1064	0.00
7	A_g	767	740	0.00
8	A_g	532	513	0.00
9	A_g	399	385	0.00
10	A_u	690	666	0.43
11	A_u	488	471	151.02
12	A_u	334	322	272.56
13	A_u	100	97	2.76
14	B_g	841	812	0.00
15	B_g	673	650	0.00
16	B_g	348	336	0.00
17	B_u	3737	3606	163.28
18	B_u	3590	3464	111.37
19	B_u	1794	1731	547.10
20	B_u	1586	1531	329.79
21	B_u	1309	1263	123.33
22	B_u	1094	1056	6.79
23	B_u	574	554	23.16
24	B_u	279	269	39.45

Atom	x (Å)	y (Å)
C1	0.000	0.774
C2	0.000	-0.774
O3	1.034	1.418
O4	-1.034	-1.418
N5	-1.253	1.263
N6	1.253	-1.263
H7	-1.414	2.255
H8	-2.017	0.604
H9	1.414	-2.255
H10	2.017	-0.604

	C1	C2	O3	O4	N5	N6	H7	H8	H9	H10
C1		1.5471	1.2189	2.4237	1.3456	2.3914	2.0483	2.0239	3.3428	2.4425
C2	1.5471		2.4237	1.2189	2.3914	1.3456	3.3428	2.4425	2.0483	2.0239
O3	1.2189	2.4237		3.5110	2.2930	2.6904	2.5873	3.1578	3.6935	2.2487
O4	2.4237	1.2189	3.5110		2.6904	2.2930	3.6935	2.2487	2.5873	3.1578
N5	1.3456	2.3914	2.2930	2.6904		3.5588	1.0054	1.0083	4.4153	3.7658
N6	2.3914	1.3456	2.6904	2.2930	3.5588		4.4153	3.7658	1.0054	1.0083
H7	2.0483	3.3428	2.5873	3.6935	1.0054	4.4153		1.7578	5.3241	4.4663
H8	2.0239	2.4425	3.1578	2.2487	1.0083	3.7658	1.7578		4.4663	4.2107
H9	3.3428	2.0483	3.6935	2.5873	4.4153	1.0054	5.3241	4.4663		1.7578
H10	2.4425	2.0239	2.2487	3.1578	3.7658	1.0083	4.4663	4.2107	1.7578

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O4	121.947	C1	C2	N6	111.332
C1	N5	H7	120.518	C1	N5	H8	117.875
C2	C1	O3	121.947	C2	C1	N5	111.332
C2	N6	H9	120.518	C2	N6	H10	117.875
O3	C1	N5	126.721	O4	C2	N6	126.721
H7	N5	H8	121.607	H9	N6	H10	121.607

All results from a given calculation for C₂H₄N₂O₂ (Oxalamide)

using model chemistry: B3LYP/6-31G(2df,p)

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	0.336
2	C	0.336
3	O	-0.375
4	O	-0.375
5	N	-0.515
6	N	-0.515
7	H	0.270
8	H	0.284
9	H	0.270
10	H	0.284

	x	y	z
x	7.797	-0.471	0.000
y	-0.471	6.666	0.000
z	0.000	0.000	3.252

<r²>	143.896
(<r²>)^1/2	11.996

All results from a given calculation for C2H4N2O2 (Oxalamide)

using model chemistry: B3LYP/6-31G(2df,p)

States and conformations

All results from a given calculation for C₂H₄N₂O₂ (Oxalamide)