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	hartrees
Energy at 0K	-286.048455
Energy at 298.15K
Nuclear repulsion energy	241.427089

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3219	3056	2.33
2	A	3113	2955	47.05
3	A	3101	2944	30.99
4	A	3094	2938	5.11
5	A	1728	1641	105.07
6	A	1545	1467	2.22
7	A	1517	1440	0.25
8	A	1494	1419	10.02
9	A	1427	1355	49.70
10	A	1384	1314	8.70
11	A	1337	1269	7.49
12	A	1263	1200	100.42
13	A	1090	1035	2.02
14	A	1033	981	84.15
15	A	993	943	2.11
16	A	961	913	25.36
17	A	917	871	22.11
18	A	754	716	6.38
19	A	668	634	2.52
20	A	350	332	5.30
21	A	3175	3014	26.76
22	A	3173	3013	7.61
23	A	3145	2986	2.64
24	A	1494	1419	8.33
25	A	1264	1200	0.08
26	A	1230	1168	2.42
27	A	1129	1072	0.04
28	A	1070	1015	1.81
29	A	837	794	0.34
30	A	594	564	3.45
31	A	241	229	10.27
32	A	142	135	0.84
33	A	60i	57i	0.02

Atom	x (Å)	y (Å)	z (Å)
C1	0.337	2.121	0.000
C2	0.542	-1.497	0.000
C3	-0.985	-1.288	0.000
N4	-1.171	0.171	0.000
O5	1.082	-0.157	0.000
C6	0.000	0.676	0.000
H7	0.907	-2.008	0.887
H8	0.907	-2.008	-0.887
H9	-1.463	-1.714	0.880
H10	-1.463	-1.714	-0.880
H11	0.932	2.363	0.879
H12	0.932	2.363	-0.879
H13	-0.576	2.705	0.000

	C1	C2	C3	N4	O5	C6	H7	H8	H9	H10	H11	H12	H13
C1		3.6240	3.6563	2.4648	2.3969	1.4840	4.2617	4.2617	4.3271	4.3271	1.0882	1.0882	1.0840
C2	3.6240		1.5411	2.3904	1.4452	2.2394	1.0871	1.0871	2.2004	2.2004	3.9779	3.9779	4.3485
C3	3.6563	1.5411		1.4705	2.3567	2.1969	2.2102	2.2102	1.0884	1.0884	4.2160	4.2160	4.0139
N4	2.4648	2.3904	1.4705		2.2767	1.2748	3.1384	3.1384	2.1007	2.1007	3.1617	3.1617	2.6030
O5	2.3969	1.4452	2.3567	2.2767		1.3657	2.0604	2.0604	3.1113	3.1113	2.6729	2.6729	3.3080
C6	1.4840	2.2394	2.1969	1.2748	1.3657		2.9686	2.9686	2.9372	2.9372	2.1181	2.1181	2.1096
H7	4.2617	1.0871	2.2102	3.1384	2.0604	2.9686		1.7749	2.3882	2.9710	4.3711	4.7144	5.0201
H8	4.2617	1.0871	2.2102	3.1384	2.0604	2.9686	1.7749		2.9710	2.3882	4.7144	4.3711	5.0201
H9	4.3271	2.2004	1.0884	2.1007	3.1113	2.9372	2.3882	2.9710		1.7597	4.7284	5.0448	4.5924
H10	4.3271	2.2004	1.0884	2.1007	3.1113	2.9372	2.9710	2.3882	1.7597		5.0448	4.7284	4.5924
H11	1.0882	3.9779	4.2160	3.1617	2.6729	2.1181	4.3711	4.7144	4.7284	5.0448		1.7572	1.7785
H12	1.0882	3.9779	4.2160	3.1617	2.6729	2.1181	4.7144	4.3711	5.0448	4.7284	1.7572		1.7785
H13	1.0840	4.3485	4.0139	2.6030	3.3080	2.1096	5.0201	5.0201	4.5924	4.5924	1.7785	1.7785

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C6	N4	126.453	C1	C6	O5	114.453
C2	C3	N4	105.045	C2	C3	H9	112.474
C2	C3	H10	112.474	C2	O5	C6	105.600
C3	C2	O5	104.169	C3	C2	H7	113.349
C3	C2	H8	113.349	C3	N4	C6	106.091
N4	C3	H9	109.452	N4	C3	H10	109.452
N4	C6	O5	119.095	O5	C2	H7	108.079
O5	C2	H8	108.079	C6	C1	H11	109.907
C6	C1	H12	109.907	C6	C1	H13	109.485
H7	C2	H8	109.439	H9	C3	H10	107.883
H11	C1	H12	107.680	H11	C1	H13	109.921
H12	C1	H13	109.921

All results from a given calculation for C₄H₇NO (Oxazole, 4,5-dihydro-2-methyl-)

using model chemistry: MP2/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 C4H7NO (Oxazole, 4,5-dihydro-2-methyl-)

using model chemistry: MP2/cc-pVTZ

States and conformations

All results from a given calculation for C₄H₇NO (Oxazole, 4,5-dihydro-2-methyl-)