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	hartrees
Energy at 0K	-302.520030
Energy at 298.15K	-302.529912
HF Energy	-301.900714
Nuclear repulsion energy	244.384944

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3644	3463	24.94
2	A	3195	3036	10.06
3	A	3141	2984	11.29
4	A	3060	2907	1.94
5	A	1707	1621	164.62
6	A	1596	1516	19.31
7	A	1567	1489	0.25
8	A	1541	1465	14.47
9	A	1504	1429	29.73
10	A	1217	1156	0.29
11	A	1195	1136	0.09
12	A	1183	1124	9.74
13	A	921	875	2.73
14	A	507	482	22.12
15	A	393	373	84.38
16	A	234	222	2.59
17	A	175	167	0.03
18	A	68	65	0.01
19	B	3640	3459	11.22
20	B	3195	3036	6.64
21	B	3141	2984	62.09
22	B	3059	2906	111.27
23	B	1610	1530	240.92
24	B	1583	1504	50.15
25	B	1557	1479	127.69
26	B	1512	1436	18.17
27	B	1313	1248	274.96
28	B	1199	1139	20.40
29	B	1187	1128	16.53
30	B	1043	991	1.53
31	B	724	688	59.55
32	B	713	677	8.63
33	B	493	468	235.49
34	B	335	318	44.68
35	B	125	119	12.41
36	B	72	69	0.04

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.089
O2	0.000	0.000	1.356
N3	0.017	1.172	-0.667
N4	-0.017	-1.172	-0.667
C5	0.000	2.480	0.009
C6	0.000	-2.480	0.009
H7	-0.307	1.133	-1.625
H8	0.307	-1.133	-1.625
H9	0.419	3.234	-0.668
H10	-0.419	-3.234	-0.668
H11	0.622	2.409	0.906
H12	-0.622	-2.409	0.906
H13	-1.012	2.786	0.314
H14	1.012	-2.786	0.314

	C1	O2	N3	N4	C5	C6	H7	H8	H9	H10	H11	H12	H13	H14
C1		1.2677	1.3947	1.3947	2.4816	2.4816	2.0771	2.0771	3.3475	3.3475	2.6190	2.6190	2.9726	2.9726
O2	1.2677		2.3382	2.3382	2.8227	2.8227	3.2041	3.2041	3.8380	3.8380	2.5287	2.5287	3.1419	3.1419
N3	1.3947	2.3382		2.3447	1.4723	3.7145	1.0123	2.5132	2.1005	4.4277	2.0902	3.9634	2.1505	4.1975
N4	1.3947	2.3382	2.3447		3.7145	1.4723	2.5132	1.0123	4.4277	2.1005	3.9634	2.0902	4.1975	2.1505
C5	2.4816	2.8227	1.4723	3.7145		4.9606	2.1398	3.9773	1.0960	5.7693	1.0936	5.0099	1.1002	5.3713
C6	2.4816	2.8227	3.7145	1.4723	4.9606		3.9773	2.1398	5.7693	1.0960	5.0099	1.0936	5.3713	1.1002
H7	2.0771	3.2041	1.0123	2.5132	2.1398	3.9773		2.3475	2.4202	4.4720	2.9826	4.3648	2.6438	4.5669
H8	2.0771	3.2041	2.5132	1.0123	3.9773	2.1398	2.3475		4.4720	2.4202	4.3648	2.9826	4.5669	2.6438
H9	3.3475	3.8380	2.1005	4.4277	1.0960	5.7693	2.4202	4.4720		6.5219	1.7879	5.9502	1.7922	6.1281
H10	3.3475	3.8380	4.4277	2.1005	5.7693	1.0960	4.4720	2.4202	6.5219		5.9502	1.7879	6.1281	1.7922
H11	2.6190	2.5287	2.0902	3.9634	1.0936	5.0099	2.9826	4.3648	1.7879	5.9502		4.9765	1.7776	5.2434
H12	2.6190	2.5287	3.9634	2.0902	5.0099	1.0936	4.3648	2.9826	5.9502	1.7879	4.9765		5.2434	1.7776
H13	2.9726	3.1419	2.1505	4.1975	1.1002	5.3713	2.6438	4.5669	1.7922	6.1281	1.7776	5.2434		5.9280
H14	2.9726	3.1419	4.1975	2.1505	5.3713	1.1002	4.5669	2.6438	6.1281	1.7922	5.2434	1.7776	5.9280

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	C5	119.874	C1	N3	H7	118.440
C1	N4	C6	119.874	C1	N4	H8	118.440
O2	C1	N3	122.796	O2	C1	N4	122.796
N3	C1	N4	114.408	N3	C5	H9	108.862
N3	C5	H11	108.189	N3	C5	H13	112.630
N4	C6	H10	108.862	N4	C6	H12	108.189
N4	C6	H14	112.630	C5	N3	H7	117.721
C6	N4	H8	117.721	H9	C5	H11	109.481
H9	C5	H13	109.387	H10	C6	H12	109.481
H10	C6	H14	109.387	H11	C5	H13	108.246
H12	C6	H14	108.246

All results from a given calculation for NH(CH₃)CONH(CH₃) (Urea, N,N'-dimethyl-)

using model chemistry: MP2=FULL/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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All results from a given calculation for NH(CH3)CONH(CH3) (Urea, N,N'-dimethyl-)

using model chemistry: MP2=FULL/6-31G

States and conformations

All results from a given calculation for NH(CH₃)CONH(CH₃) (Urea, N,N'-dimethyl-)