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	hartrees
Energy at 0K	-267.070475
Energy at 298.15K	-267.079242
Nuclear repulsion energy	234.129950

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3530	3117	16.47
2	A	3517	3105	0.06
3	A	3485	3077	0.00
4	A	3442	3040	2.63
5	A	3421	3020	2.18
6	A	3342	2951	4.21
7	A	3331	2941	0.08
8	A	3317	2929	6.58
9	A	1880	1660	28.47
10	A	1678	1481	0.02
11	A	1665	1470	6.06
12	A	1656	1463	0.22
13	A	1655	1461	4.74
14	A	1559	1377	4.08
15	A	1504	1328	8.58
16	A	1434	1266	9.66
17	A	1380	1219	57.90
18	A	1334	1178	0.03
19	A	1298	1146	10.12
20	A	1255	1109	1.42
21	A	1156	1021	8.08
22	A	1147	1013	5.78
23	A	1134	1002	1.35
24	A	1112	982	4.70
25	A	1065	940	4.16
26	A	1017	898	6.08
27	A	956	844	6.74
28	A	876	774	0.01
29	A	778	687	14.09
30	A	766	677	0.32
31	A	652	576	1.26
32	A	531	469	1.34
33	A	327	289	1.51
34	A	231	204	4.76
35	A	127	112	1.85
36	A	105	93	0.02

Atom	x (Å)	y (Å)	z (Å)
C1	-1.397	-0.811	-0.000
H2	-1.855	-1.274	-0.897
H3	-1.857	-1.275	0.895
O4	0.049	-1.148	0.000
C5	-1.545	0.744	0.000
H6	-2.094	1.096	0.890
H7	-2.096	1.097	-0.888
C8	-0.089	1.182	-0.000
H9	0.234	2.222	-0.001
C10	2.227	0.009	0.000
H11	2.583	-0.538	-0.886
H12	2.664	1.016	-0.007
H13	2.584	-0.525	0.893
C14	0.710	0.103	-0.000

	C1	H2	H3	O4	C5	H6	H7	C8	H9	C10	H11	H12	H13	C14
C1		1.1082	1.1082	1.4849	1.5617	2.2170	2.2171	2.3838	3.4440	3.7156	4.0863	4.4524	4.0897	2.2963
H2	1.1082		1.7918	2.1091	2.2298	2.9776	2.3828	3.1551	4.1704	4.3724	4.4991	5.1434	4.8447	3.0462
H3	1.1082	1.7918		2.1092	2.2298	2.3825	2.9766	3.1563	4.1717	4.3734	4.8399	5.1471	4.5033	3.0472
O4	1.4849	2.1091	2.1092		2.4737	3.2281	3.2294	2.3339	3.3754	2.4663	2.7528	3.3937	2.7584	1.4144
C5	1.5617	2.2298	2.2298	2.4737		1.1034	1.1033	1.5205	2.3131	3.8426	4.4120	4.2170	4.4105	2.3440
H6	2.2170	2.9776	2.3825	3.2281	1.1034		1.7781	2.1959	2.7355	4.5437	5.2628	4.8421	4.9508	3.1050
H7	2.2171	2.3828	2.9766	3.2294	1.1033	1.7781		2.1961	2.7353	4.5450	4.9560	4.8407	5.2632	3.1061
C8	2.3838	3.1551	3.1563	2.3339	1.5205	2.1959	2.1961		1.0895	2.5956	3.2982	2.7572	3.2947	1.3425
H9	3.4440	4.1704	4.1717	3.3754	2.3131	2.7355	2.7353	1.0895		2.9781	3.7308	2.7125	3.7242	2.1724
C10	3.7156	4.3724	4.3734	2.4663	3.8426	4.5437	4.5450	2.5956	2.9781		1.1003	1.0971	1.1003	1.5200
H11	4.0863	4.4991	4.8399	2.7528	4.4120	5.2628	4.9560	3.2982	3.7308	1.1003		1.7867	1.7789	2.1686
H12	4.4524	5.1434	5.1471	3.3937	4.2170	4.8421	4.8407	2.7572	2.7125	1.0971	1.7867		1.7866	2.1565
H13	4.0897	4.8447	4.5033	2.7584	4.4105	4.9508	5.2632	3.2947	3.7242	1.1003	1.7789	1.7866		2.1688
C14	2.2963	3.0462	3.0472	1.4144	2.3440	3.1050	3.1061	1.3425	2.1724	1.5200	2.1686	2.1565	2.1688

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O4	C14	104.723	C1	C5	H6	111.422
C1	C5	H7	111.433	C1	C5	C8	101.312
H2	C1	H3	107.881	H2	C1	O4	107.971
H2	C1	C5	112.151	H3	C1	O4	107.977
H3	C1	C5	112.147	O4	C1	C5	108.553
O4	C14	C8	115.654	O4	C14	C10	114.325
C5	C8	H9	123.977	C5	C8	C14	109.758
H6	C5	H7	107.367	H6	C5	C8	112.660
H7	C5	C8	112.681	C8	C14	C10	130.021
H9	C8	C14	126.265	H11	C10	H12	108.799
H11	C10	H13	107.874	H11	C10	C14	110.692
H12	C10	H13	108.787	H12	C10	C14	109.922
H13	C10	C14	110.705

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

using model chemistry: B1B95/STO-3G

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	-0.051
2	H	0.082
3	H	0.082
4	O	-0.180
5	C	-0.150
6	H	0.080
7	H	0.080
8	C	-0.137
9	H	0.076
10	C	-0.239
11	H	0.092
12	H	0.091
13	H	0.092
14	C	0.081

	x	y	z	Total
	-0.343	0.482	0.000	0.592
CHELPG
AIM
ESP

	x	y	z
x	5.716	-0.266	0.001
y	-0.266	5.004	-0.000
z	0.001	-0.000	2.715

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: B1B95/STO-3G

States and conformations

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