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	hartrees
Energy at 0K	-270.393469
Energy at 298.15K	-270.402489
HF Energy	-270.393469
Nuclear repulsion energy	236.571089

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3200	3145	7.05
2	A	3094	3041	17.93
3	A	3074	3021	39.12
4	A	3047	2995	15.12
5	A	3019	2967	47.54
6	A	2988	2937	33.02
7	A	2986	2935	55.66
8	A	2954	2903	65.48
9	A	1683	1654	58.76
10	A	1489	1464	0.44
11	A	1470	1445	0.71
12	A	1463	1438	6.66
13	A	1448	1423	8.16
14	A	1391	1367	14.75
15	A	1368	1345	9.99
16	A	1294	1272	10.11
17	A	1238	1217	34.23
18	A	1223	1202	15.91
19	A	1181	1161	7.70
20	A	1171	1151	45.19
21	A	1059	1041	0.36
22	A	1035	1017	2.12
23	A	1011	993	11.75
24	A	989	972	23.66
25	A	948	932	38.76
26	A	915	899	14.28
27	A	888	873	24.61
28	A	839	825	8.43
29	A	693	681	29.98
30	A	674	662	8.68
31	A	619	609	1.13
32	A	539	530	0.69
33	A	331	325	2.93
34	A	218	215	8.36
35	A	163	160	2.91
36	A	126	124	1.12

Atom	x (Å)	y (Å)	z (Å)
C1	-1.371	-0.816	0.101
H2	-1.932	-1.425	-0.617
H3	-1.624	-1.133	1.125
O4	0.050	-1.101	-0.099
C5	-1.543	0.712	-0.079
H6	-2.218	1.132	0.681
H7	-1.964	0.969	-1.066
C8	-0.107	1.178	0.055
H9	0.215	2.214	0.104
C10	2.202	0.005	0.010
H11	2.558	-0.488	-0.907
H12	2.655	1.001	0.074
H13	2.547	-0.600	0.861
C14	0.713	0.110	0.002

	C1	H2	H3	O4	C5	H6	H7	C8	H9	C10	H11	H12	H13	C14
C1		1.0957	1.1009	1.4632	1.5486	2.2016	2.2143	2.3620	3.4199	3.6677	4.0697	4.4174	3.9968	2.2835
H2	1.0957		1.7926	2.0739	2.2379	2.8814	2.4364	3.2495	4.2858	4.4190	4.5956	5.2346	4.7878	3.1206
H3	1.1009	1.7926		2.0739	2.2047	2.3830	3.0557	2.9645	3.9527	4.1448	4.6940	4.8958	4.2130	2.8758
O4	1.4632	2.0739	2.0739		2.4133	3.2764	3.0459	2.2899	3.3249	2.4221	2.7053	3.3516	2.7215	1.3847
C5	1.5486	2.2379	2.2047	2.4133		1.0995	1.1039	1.5153	2.3187	3.8120	4.3520	4.2103	4.3962	2.3364
H6	2.2016	2.8814	2.3830	3.2764	1.0995		1.7730	2.2019	2.7239	4.6104	5.2868	4.9122	5.0723	3.1773
H7	2.2143	2.4364	3.0557	3.0459	1.1039	1.7730		2.1794	2.7686	4.4095	4.7534	4.7576	5.1499	3.0080
C8	2.3620	3.2495	2.9645	2.2899	1.5153	2.2019	2.1794		1.0852	2.5907	3.2870	2.7678	3.2943	1.3479
H9	3.4199	4.2858	3.9527	3.3249	2.3187	2.7239	2.7686	1.0852		2.9728	3.7164	2.7253	3.7316	2.1641
C10	3.6677	4.4190	4.1448	2.4221	3.8120	4.6104	4.4095	2.5907	2.9728		1.0999	1.0959	1.0996	1.4925
H11	4.0697	4.5956	4.6940	2.7053	4.3520	5.2868	4.7534	3.2870	3.7164	1.0999		1.7854	1.7719	2.1416
H12	4.4174	5.2346	4.8958	3.3516	4.2103	4.9122	4.7576	2.7678	2.7253	1.0959	1.7854		1.7868	2.1373
H13	3.9968	4.7878	4.2130	2.7215	4.3962	5.0723	5.1499	3.2943	3.7316	1.0996	1.7719	1.7868		2.1453
C14	2.2835	3.1206	2.8758	1.3847	2.3364	3.1773	3.0080	1.3479	2.1641	1.4925	2.1416	2.1373	2.1453

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O4	C14	107.167	C1	C5	H6	111.356
C1	C5	H7	112.082	C1	C5	C8	101.083
H2	C1	H3	109.033	H2	C1	O4	107.728
H2	C1	C5	114.159	H3	C1	O4	107.285
H3	C1	C5	111.768	O4	C1	C5	106.542
O4	C14	C8	113.691	O4	C14	C10	114.650
C5	C8	H9	125.226	C5	C8	C14	109.435
H6	C5	H7	106.986	H6	C5	C8	113.579
H7	C5	C8	111.835	C8	C14	C10	131.650
H9	C8	C14	125.210	H11	C10	H12	108.793
H11	C10	H13	107.332	H11	C10	C14	110.486
H12	C10	H13	108.912	H12	C10	C14	110.499
H13	C10	C14	110.734

All results from a given calculation for C₅H₈O (Furan, 2,3-dihydro-5-methyl-)

using model chemistry: B97D3/6-31+G**

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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Number	Element	Mulliken
1	C	-0.018
2	H	0.146
3	H	0.145
4	O	-0.274
5	C	-0.482
6	H	0.155
7	H	0.158
8	C	0.204
9	H	0.134
10	C	-0.686
11	H	0.173
12	H	0.163
13	H	0.173
14	C	0.009

	x	y	z	Total
	-0.484	0.706	0.107	0.862
CHELPG
AIM
ESP

	x	y	z
x	11.004	-0.620	0.008
y	-0.620	9.632	0.014
z	0.008	0.014	7.314

<r²>	157.907
(<r²>)^1/2	12.566

All results from a given calculation for C5H8O (Furan, 2,3-dihydro-5-methyl-)

using model chemistry: B97D3/6-31+G**

States and conformations

All results from a given calculation for C₅H₈O (Furan, 2,3-dihydro-5-methyl-)