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	hartrees
Energy at 0K	-303.341127
Energy at 298.15K	-303.351358
HF Energy	-302.158836
Nuclear repulsion energy	249.565570

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3694	3490	31.39
2	A	3198	3021	11.27
3	A	3156	2982	8.28
4	A	3077	2907	4.76
5	A	1849	1747	283.51
6	A	1555	1469	17.16
7	A	1520	1436	0.55
8	A	1505	1422	3.62
9	A	1472	1391	4.49
10	A	1230	1162	0.12
11	A	1205	1138	1.23
12	A	1166	1101	6.00
13	A	949	896	0.98
14	A	555	525	92.35
15	A	446	421	47.12
16	A	224	211	4.06
17	A	196	185	0.18
18	A	115	108	0.34
19	B	3692	3488	11.31
20	B	3198	3021	5.75
21	B	3156	2982	42.43
22	B	3077	2907	89.21
23	B	1605	1516	406.94
24	B	1537	1452	1.53
25	B	1512	1429	53.30
26	B	1475	1393	7.50
27	B	1302	1230	205.12
28	B	1179	1114	21.94
29	B	1166	1102	5.47
30	B	1073	1014	1.42
31	B	801	757	26.66
32	B	754	712	22.08
33	B	500	473	95.58
34	B	320	302	44.42
35	B	126	119	3.77
36	B	123	116	5.20

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.088
O2	0.000	0.000	1.298
N3	0.000	1.155	-0.665
N4	0.000	-1.155	-0.665
C5	-0.248	2.407	0.026
C6	0.248	-2.407	0.026
H7	-0.421	1.068	-1.571
H8	0.421	-1.068	-1.571
H9	-0.082	3.228	-0.666
H10	0.082	-3.228	-0.666
H11	0.447	2.498	0.853
H12	-0.447	-2.498	0.853
H13	-1.260	2.474	0.428
H14	1.260	-2.474	0.428

	C1	O2	N3	N4	C5	C6	H7	H8	H9	H10	H11	H12	H13	H14
C1		1.2103	1.3786	1.3786	2.4210	2.4210	2.0175	2.0175	3.3159	3.3159	2.6505	2.6505	2.7974	2.7974
O2	1.2103		2.2779	2.2779	2.7343	2.7343	3.0905	3.0905	3.7797	3.7797	2.5765	2.5765	2.9099	2.9099
N3	1.3786	2.2779		2.3091	1.4522	3.6368	1.0028	2.4363	2.0750	4.3832	2.0760	3.9807	2.1271	3.9940
N4	1.3786	2.2779	2.3091		3.6368	1.4522	2.4363	1.0028	4.3832	2.0750	3.9807	2.0760	3.9940	2.1271
C5	2.4210	2.7343	1.4522	3.6368		4.8403	2.0918	3.8825	1.0863	5.6873	1.0845	4.9786	1.0906	5.1253
C6	2.4210	2.7343	3.6368	1.4522	4.8403		3.8825	2.0918	5.6873	1.0863	4.9786	1.0845	5.1253	1.0906
H7	2.0175	3.0905	1.0028	2.4363	2.0918	3.8825		2.2951	2.3666	4.4184	2.9457	4.3116	2.5845	4.4009
H8	2.0175	3.0905	2.4363	1.0028	3.8825	2.0918	2.2951		4.4184	2.3666	4.3116	2.9457	4.4009	2.5845
H9	3.3159	3.7797	2.0750	4.3832	1.0863	5.6873	2.3666	4.4184		6.4579	1.7668	5.9353	1.7754	5.9595
H10	3.3159	3.7797	4.3832	2.0750	5.6873	1.0863	4.4184	2.3666	6.4579		5.9353	1.7668	5.9595	1.7754
H11	2.6505	2.5765	2.0760	3.9807	1.0845	4.9786	2.9457	4.3116	1.7668	5.9353		5.0754	1.7594	5.0562
H12	2.6505	2.5765	3.9807	2.0760	4.9786	1.0845	4.3116	2.9457	5.9353	1.7668	5.0754		5.0562	1.7594
H13	2.7974	2.9099	2.1271	3.9940	1.0906	5.1253	2.5845	4.4009	1.7754	5.9595	1.7594	5.0562		5.5534
H14	2.7974	2.9099	3.9940	2.1271	5.1253	1.0906	4.4009	2.5845	5.9595	1.7754	5.0562	1.7594	5.5534

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	C5	117.543	C1	N3	H7	114.898
C1	N4	C6	117.543	C1	N4	H8	114.898
O2	C1	N3	123.126	O2	C1	N4	123.126
N3	C1	N4	113.749	N3	C5	H9	108.795
N3	C5	H11	108.989	N3	C5	H13	112.773
N4	C6	H10	108.795	N4	C6	H12	108.989
N4	C6	H14	112.773	C5	N3	H7	115.661
C6	N4	H8	115.661	H9	C5	H11	108.957
H9	C5	H13	109.290	H10	C6	H12	108.957
H10	C6	H14	109.290	H11	C5	H13	107.972
H12	C6	H14	107.972

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

using model chemistry: MP3/cc-pVTZ

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: MP3/cc-pVTZ

States and conformations

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