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	hartrees
Energy at 0K	-267.342052
Energy at 298.15K	-267.351456
Nuclear repulsion energy	237.161666

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3434	3100	3.72
2	A	3312	2990	41.84
3	A	3292	2972	13.62
4	A	3262	2945	50.33
5	A	3257	2940	12.33
6	A	3247	2931	14.14
7	A	3218	2904	39.69
8	A	3208	2896	15.35
9	A	1883	1699	57.53
10	A	1688	1524	0.03
11	A	1659	1497	1.86
12	A	1656	1494	8.57
13	A	1644	1484	7.31
14	A	1583	1429	8.19
15	A	1514	1367	3.51
16	A	1444	1304	19.13
17	A	1400	1263	26.42
18	A	1384	1249	0.83
19	A	1317	1189	2.36
20	A	1289	1163	77.24
21	A	1216	1098	11.56
22	A	1182	1067	0.48
23	A	1160	1047	15.69
24	A	1072	967	51.60
25	A	1047	945	7.38
26	A	957	863	49.48
27	A	929	839	3.70
28	A	927	836	25.05
29	A	878	793	13.60
30	A	797	719	1.81
31	A	660	596	2.46
32	A	606	547	2.18
33	A	343	309	3.17
34	A	243	219	10.54
35	A	177	160	2.13
36	A	82	74	3.94

Atom	x (Å)	y (Å)	z (Å)
C1	1.405	-0.816	-0.001
H2	1.832	-1.263	0.882
H3	1.831	-1.261	-0.885
O4	-0.033	-1.103	0.000
C5	1.529	0.744	0.000
H6	2.055	1.098	-0.877
H7	2.054	1.097	0.880
C8	0.066	1.165	-0.000
H9	-0.261	2.180	-0.001
C10	-2.203	-0.012	-0.000
H11	-2.525	-0.564	0.876
H12	-2.670	0.962	-0.002
H13	-2.525	-0.567	-0.874
C14	-0.718	0.109	0.000

	C1	H2	H3	O4	C5	H6	H7	C8	H9	C10	H11	H12	H13	C14
C1		1.0780	1.0781	1.4665	1.5643	2.2033	2.2032	2.3906	3.4277	3.6959	4.0345	4.4462	4.0332	2.3151
H2	1.0780		1.7673	2.0698	2.2126	2.9530	2.3702	3.1293	4.1249	4.3155	4.4134	5.0998	4.7490	3.0270
H3	1.0781	1.7673		2.0699	2.2125	2.3702	2.9539	3.1278	4.1232	4.3142	4.7500	5.0976	4.4106	3.0258
O4	1.4665	2.0698	2.0699		2.4184	3.1585	3.1570	2.2697	3.2905	2.4279	2.6956	3.3492	2.6942	1.3914
C5	1.5643	2.2126	2.2125	2.4184		1.0832	1.0833	1.5221	2.2949	3.8074	4.3488	4.2050	4.3491	2.3344
H6	2.2033	2.9530	2.3702	3.1585	1.0832		1.7571	2.1749	2.7025	4.4871	5.1786	4.8081	4.8735	3.0721
H7	2.2032	2.3702	2.9539	3.1570	1.0833	1.7571		2.1746	2.7028	4.4857	4.8708	4.8076	5.1776	3.0708
C8	2.3906	3.1293	3.1278	2.2697	1.5221	2.1749	2.1746		1.0665	2.5562	3.2361	2.7442	3.2368	1.3151
H9	3.4277	4.1249	4.1232	3.2905	2.2949	2.7025	2.7028	1.0665		2.9289	3.6640	2.7000	3.6655	2.1209
C10	3.6959	4.3155	4.3142	2.4279	3.8074	4.4871	4.4857	2.5562	2.9289		1.0841	1.0810	1.0841	1.4900
H11	4.0345	4.4134	4.7500	2.6956	4.3488	5.1786	4.8708	3.2361	3.6640	1.0841		1.7664	1.7500	2.1183
H12	4.4462	5.0998	5.0976	3.3492	4.2050	4.8081	4.8076	2.7442	2.7000	1.0810	1.7664		1.7664	2.1311
H13	4.0332	4.7490	4.4106	2.6942	4.3491	4.8735	5.1776	3.2368	3.6655	1.0841	1.7500	1.7664		2.1182
C14	2.3151	3.0270	3.0258	1.3914	2.3344	3.0721	3.0708	1.3151	2.1209	1.4900	2.1183	2.1311	2.1182

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O4	C14	108.178	C1	C5	H6	111.362
C1	C5	H7	111.351	C1	C5	C8	101.522
H2	C1	H3	110.101	H2	C1	O4	107.891
H2	C1	C5	112.426	H3	C1	O4	107.891
H3	C1	C5	112.414	O4	C1	C5	105.828
O4	C14	C8	113.954	O4	C14	C10	114.784
C5	C8	H9	123.927	C5	C8	C14	110.518
H6	C5	H7	108.396	H6	C5	C8	112.087
H7	C5	C8	112.066	C8	C14	C10	131.262
H9	C8	C14	125.556	H11	C10	H12	109.342
H11	C10	H13	107.626	H11	C10	C14	109.752
H12	C10	H13	109.345	H12	C10	C14	110.966
H13	C10	C14	109.744

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

using model chemistry: HF/3-21G*

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	CHELPG
1	C	-0.094	0.017
2	H	0.220	0.070
3	H	0.220	0.070
4	O	-0.677	-0.442
5	C	-0.476	0.296
6	H	0.225	-0.036
7	H	0.225	-0.036
8	C	-0.347	-0.550
9	H	0.225	0.187
10	C	-0.631	-0.487
11	H	0.238	0.150
12	H	0.218	0.143
13	H	0.238	0.151
14	C	0.416	0.468

	x	y	z	Total
	0.525	1.141	-0.001	1.256
CHELPG	0.512	1.106	-0.001	1.219
AIM
ESP

	x	y	z
x	8.574	0.630	-0.000
y	0.630	7.553	-0.000
z	-0.000	-0.000	4.966

<r²>	157.528
(<r²>)^1/2	12.551

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

using model chemistry: HF/3-21G*

States and conformations

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