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	hartrees
Energy at 0K	-303.322344
Energy at 298.15K	-303.332605
HF Energy	-302.165399
Nuclear repulsion energy	254.517164

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3728	3547	36.09
2	A	3608	3433	29.61
3	A	3214	3058	0.19
4	A	3180	3026	7.55
5	A	3136	2984	7.02
6	A	3128	2976	41.29
7	A	3059	2910	61.12
8	A	3039	2892	54.18
9	A	1769	1684	430.00
10	A	1632	1553	147.96
11	A	1558	1483	74.57
12	A	1528	1454	14.51
13	A	1520	1446	6.98
14	A	1517	1443	15.90
15	A	1490	1418	72.55
16	A	1445	1375	100.45
17	A	1443	1373	31.93
18	A	1326	1262	26.43
19	A	1281	1219	49.72
20	A	1183	1126	4.55
21	A	1143	1088	3.66
22	A	1108	1054	59.38
23	A	1097	1044	15.25
24	A	1042	992	23.59
25	A	784	746	26.96
26	A	778	740	19.72
27	A	605	576	35.40
28	A	582	554	158.66
29	A	515	490	6.66
30	A	442	421	31.40
31	A	391	372	12.12
32	A	320	305	9.61
33	A	180	172	2.75
34	A	157	150	1.60
35	A	130	124	6.60
36	A	77	74	0.39

Atom	x (Å)	y (Å)	z (Å)
H1	2.522	0.664	0.181
O2	1.237	-1.334	-0.070
C3	0.759	-0.208	-0.028
N4	-0.587	0.039	-0.026
H5	1.258	1.688	0.583
N6	1.567	0.928	0.000
H7	-2.177	-1.099	-0.771
H8	-2.097	-0.995	0.996
H9	-0.921	-1.990	0.110
C10	-1.501	-1.075	0.085
H11	-1.342	1.775	0.928
H12	-2.108	1.318	-0.594
H13	-0.505	2.039	-0.620
C14	-1.156	1.366	-0.069

	H1	O2	C3	N4	H5	N6	H7	H8	H9	C10	H11	H12	H13	C14
H1		2.3879	1.9778	3.1771	1.6759	1.0074	5.1075	4.9751	4.3470	4.3838	4.0893	4.7400	3.4198	3.7523
O2	2.3879		1.2245	2.2836	3.0915	2.2872	3.4931	3.5174	2.2628	2.7554	4.1611	4.3014	3.8361	3.6076
C3	1.9778	1.2245		1.3676	2.0530	1.3945	3.1562	3.1344	2.4527	2.4233	3.0426	3.2967	2.6449	2.4783
N4	3.1771	2.2836	1.3676		2.5474	2.3298	2.0926	2.0966	2.0612	1.4460	2.1196	2.0674	2.0878	1.4440
H5	1.6759	3.0915	2.0530	2.5474		1.0060	4.6252	4.3156	4.3005	3.9361	2.6239	3.5850	2.1626	2.5206
N6	1.0074	2.2872	1.3945	2.3298	1.0060		4.3263	4.2564	3.8362	3.6653	3.1684	3.7432	2.4311	2.7583
H7	5.1075	3.4931	3.1562	2.0926	4.6252	4.3263		1.7714	1.7743	1.0905	3.4412	2.4246	3.5588	2.7585
H8	4.9751	3.5174	3.1344	2.0966	4.3156	4.2564	1.7714		1.7773	1.0912	2.8720	2.8068	3.7883	2.7558
H9	4.3470	2.2628	2.4527	2.0612	4.3005	3.8362	1.7743	1.7773		1.0841	3.8758	3.5849	4.1159	3.3689
C10	4.3838	2.7554	2.4233	1.4460	3.9361	3.6653	1.0905	1.0912	1.0841		2.9763	2.5607	3.3448	2.4700
H11	4.0893	4.1611	3.0426	2.1196	2.6239	3.1684	3.4412	2.8720	3.8758	2.9763		1.7640	1.7789	1.0938
H12	4.7400	4.3014	3.2967	2.0674	3.5850	3.7432	2.4246	2.8068	3.5849	2.5607	1.7640		1.7582	1.0887
H13	3.4198	3.8361	2.6449	2.0878	2.1626	2.4311	3.5588	3.7883	4.1159	3.3448	1.7789	1.7582		1.0861
C14	3.7523	3.6076	2.4783	1.4440	2.5206	2.7583	2.7585	2.7558	3.3689	2.4700	1.0938	1.0887	1.0861

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	N6	C3	109.810	H1	N6	H5	112.694
O2	C3	N4	123.422	O2	C3	N6	121.553
C3	N4	C10	118.892	C3	N4	C14	123.606
C3	N6	H5	116.650	N4	C3	N6	115.017
N4	C10	H7	110.389	N4	C10	H8	110.673
N4	C10	H9	108.261	N4	C14	H11	112.542
N4	C14	H12	108.619	N4	C14	H13	110.411
H7	C10	H8	108.566	H7	C10	H9	109.356
H8	C10	H9	109.581	C10	N4	C14	117.444
H11	C14	H12	107.853	H11	C14	H13	109.383
H12	C14	H13	107.891

All results from a given calculation for N(CH₃)₂CONH₂ (Urea, N,N-dimethyl-)

using model chemistry: MP2/Def2TZVPP

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 N(CH3)2CONH2 (Urea, N,N-dimethyl-)

using model chemistry: MP2/Def2TZVPP

States and conformations

All results from a given calculation for N(CH₃)₂CONH₂ (Urea, N,N-dimethyl-)