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	hartrees
Energy at 0K	-247.783749
Energy at 298.15K	-247.792059
HF Energy	-246.986701
Nuclear repulsion energy	180.606325

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3191	3046
2	A'	3151	3008
3	A'	3047	2909
4	A'	3039	2901
5	A'	2974	2839
6	A'	1761	1682
7	A'	1576	1504
8	A'	1548	1478
9	A'	1499	1431
10	A'	1465	1399
11	A'	1457	1391
12	A'	1440	1375
13	A'	1311	1251
14	A'	1115	1065
15	A'	1100	1050
16	A'	889	849
17	A'	658	628
18	A'	395	377
19	A'	327	312
20	A"	3110	2970
21	A"	3102	2962
22	A"	1542	1472
23	A"	1519	1450
24	A"	1195	1141
25	A"	1147	1095
26	A"	1004	959
27	A"	331	316
28	A"	228	217
29	A"	169	161
30	A"	88	84

Atom	x (Å)	y (Å)	z (Å)
C1	0.705	-0.821	0.000
O2	0.214	-1.953	0.000
N3	0.000	0.352	0.000
C4	-1.455	0.326	0.000
C5	0.658	1.647	0.000
H6	1.802	-0.647	0.000
H7	-1.769	-0.721	0.000
H8	-1.848	0.831	0.894
H9	-1.848	0.831	-0.894
H10	1.744	1.503	0.000
H11	0.379	2.226	-0.893
H12	0.379	2.226	0.893

	C1	O2	N3	C4	C5	H6	H7	H8	H9	H10	H11	H12
C1		1.2338	1.3686	2.4454	2.4678	1.1102	2.4758	3.1697	3.1697	2.5456	3.1913	3.1913
O2	1.2338		2.3146	2.8241	3.6264	2.0555	2.3338	3.5776	3.5776	3.7794	4.2758	4.2758
N3	1.3686	2.3146		1.4549	1.4519	2.0605	2.0687	2.1080	2.1080	2.0898	2.1098	2.1098
C4	2.4454	2.8241	1.4549		2.4911	3.3988	1.0930	1.0995	1.0995	3.4088	2.7874	2.7874
C5	2.4678	3.6264	1.4519	2.4911		2.5635	3.3900	2.7826	2.7826	1.0963	1.0999	1.0999
H6	1.1102	2.0555	2.0605	3.3988	2.5635		3.5711	4.0381	4.0381	2.1512	3.3280	3.3280
H7	2.4758	2.3338	2.0687	1.0930	3.3900	3.5711		1.7928	1.7928	4.1578	3.7542	3.7542
H8	3.1697	3.5776	2.1080	1.0995	2.7826	4.0381	1.7928		1.7877	3.7626	3.1778	2.6280
H9	3.1697	3.5776	2.1080	1.0995	2.7826	4.0381	1.7928	1.7877		3.7626	2.6280	3.1778
H10	2.5456	3.7794	2.0898	3.4088	1.0963	2.1512	4.1578	3.7626	3.7626		1.7841	1.7841
H11	3.1913	4.2758	2.1098	2.7874	1.0999	3.3280	3.7542	3.1778	2.6280	1.7841		1.7853
H12	3.1913	4.2758	2.1098	2.7874	1.0999	3.3280	3.7542	2.6280	3.1778	1.7841	1.7853

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	C4	119.984	C1	N3	C5	122.053
O2	C1	N3	125.517	O2	C1	H6	122.452
N3	C1	H6	112.031	N3	C4	H7	107.720
N3	C4	H8	110.458	N3	C4	H9	110.458
N3	C5	H10	109.407	N3	C5	H11	110.786
N3	C5	H12	110.786	C4	N3	C5	117.963
H7	C4	H8	109.709	H7	C4	H9	109.709
H8	C4	H9	108.776	H10	C5	H11	108.653
H10	C5	H12	108.653	H11	C5	H12	108.499

All results from a given calculation for C₃H₇NO (dimethylformamide)

using model chemistry: MP4/6-31G*

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 C3H7NO (dimethylformamide)

using model chemistry: MP4/6-31G*

States and conformations

All results from a given calculation for C₃H₇NO (dimethylformamide)