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	hartrees
Energy at 0K	-270.415653
Energy at 298.15K	-270.424836
Nuclear repulsion energy	239.049936

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3288	3121	4.35
2	A	3190	3028	12.53
3	A	3158	2997	37.62
4	A	3145	2986	12.04
5	A	3113	2955	36.38
6	A	3081	2925	20.27
7	A	3075	2919	48.03
8	A	3050	2896	50.07
9	A	1776	1686	56.71
10	A	1549	1470	0.27
11	A	1524	1447	0.36
12	A	1517	1441	4.20
13	A	1500	1424	7.79
14	A	1449	1375	30.49
15	A	1426	1354	4.10
16	A	1349	1281	11.21
17	A	1290	1225	61.34
18	A	1275	1211	6.60
19	A	1232	1170	30.12
20	A	1224	1162	4.77
21	A	1093	1038	0.61
22	A	1079	1024	44.19
23	A	1073	1019	12.94
24	A	1043	990	5.34
25	A	1002	951	10.54
26	A	961	912	15.38
27	A	936	888	22.25
28	A	870	826	3.44
29	A	742	704	26.15
30	A	692	657	0.72
31	A	640	607	1.22
32	A	561	532	1.87
33	A	333	316	2.16
34	A	227	215	6.19
35	A	173	164	2.46
36	A	126	120	1.65

Atom	x (Å)	y (Å)	z (Å)
C1	-1.346	-0.812	0.100
H2	-1.911	-1.418	-0.608
H3	-1.605	-1.125	1.117
O4	0.048	-1.086	-0.099
C5	-1.530	0.702	-0.077
H6	-2.202	1.114	0.680
H7	-1.954	0.959	-1.056
C8	-0.108	1.169	0.053
H9	0.211	2.199	0.105
C10	2.180	0.006	0.010
H11	2.533	-0.492	-0.897
H12	2.638	0.993	0.069
H13	2.519	-0.593	0.860
C14	0.701	0.110	0.000

	C1	H2	H3	O4	C5	H6	H7	C8	H9	C10	H11	H12	H13	C14
C1		1.0903	1.0951	1.4339	1.5356	2.1863	2.2010	2.3357	3.3891	3.6204	4.0173	4.3730	3.9447	2.2470
H2	1.0903		1.7760	2.0506	2.2188	2.8560	2.4196	3.2215	4.2534	4.3756	4.5482	5.1922	4.7391	3.0868
H3	1.0951	1.7760		2.0522	2.1847	2.3587	3.0316	2.9385	3.9209	4.1028	4.6454	4.8565	4.1662	2.8447
O4	1.4339	2.0506	2.0522		2.3848	3.2421	3.0177	2.2650	3.2953	2.3982	2.6768	3.3253	2.6964	1.3668
C5	1.5356	2.2188	2.1847	2.3848		1.0936	1.0974	1.5020	2.3026	3.7760	4.3133	4.1800	4.3533	2.3095
H6	2.1863	2.8560	2.3587	3.2421	1.0936		1.7611	2.1870	2.7076	4.5701	5.2432	4.8799	5.0240	3.1465
H7	2.2010	2.4196	3.0316	3.0177	1.0974	1.7611		2.1641	2.7515	4.3749	4.7185	4.7277	5.1081	2.9811
C8	2.3357	3.2215	2.9385	2.2650	1.5020	2.1870	2.1641		1.0798	2.5671	3.2612	2.7511	3.2644	1.3331
H9	3.3891	4.2534	3.9209	3.2953	2.3026	2.7076	2.7515	1.0798		2.9494	3.6931	2.7102	3.7010	2.1479
C10	3.6204	4.3756	4.1028	2.3982	3.7760	4.5701	4.3749	2.5671	2.9494		1.0936	1.0898	1.0935	1.4829
H11	4.0173	4.5482	4.6454	2.6768	4.3133	5.2432	4.7185	3.2612	3.6931	1.0936		1.7752	1.7605	2.1269
H12	4.3730	5.1922	4.8565	3.3253	4.1800	4.8799	4.7277	2.7511	2.7102	1.0898	1.7752		1.7767	2.1292
H13	3.9447	4.7391	4.1662	2.6964	4.3533	5.0240	5.1081	3.2644	3.7010	1.0935	1.7605	1.7767		2.1306
C14	2.2470	3.0868	2.8447	1.3668	2.3095	3.1465	2.9811	1.3331	2.1479	1.4829	2.1269	2.1292	2.1306

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O4	C14	106.681	C1	C5	H6	111.402
C1	C5	H7	112.353	C1	C5	C8	100.505
H2	C1	H3	108.713	H2	C1	O4	107.881
H2	C1	C5	114.267	H3	C1	O4	107.731
H3	C1	C5	111.189	O4	C1	C5	106.803
O4	C14	C8	114.049	O4	C14	C10	114.554
C5	C8	H9	125.419	C5	C8	C14	108.950
H6	C5	H7	106.984	H6	C5	C8	113.899
H7	C5	C8	111.776	C8	C14	C10	131.390
H9	C8	C14	125.475	H11	C10	H12	108.785
H11	C10	H13	107.204	H11	C10	C14	110.367
H12	C10	H13	108.932	H12	C10	C14	110.787
H13	C10	C14	110.671

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

using model chemistry: B1B95/6-31G*

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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Number	Element	Mulliken
1	C	-0.067
2	H	0.169
3	H	0.164
4	O	-0.508
5	C	-0.366
6	H	0.168
7	H	0.170
8	C	-0.262
9	H	0.150
10	C	-0.556
11	H	0.188
12	H	0.179
13	H	0.187
14	C	0.385

	x	y	z	Total
	-0.366	0.678	0.149	0.785
CHELPG
AIM
ESP

	x	y	z
x	9.522	-0.545	0.027
y	-0.545	8.114	0.009
z	0.027	0.009	5.688

<r²>	154.517
(<r²>)^1/2	12.430

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

using model chemistry: B1B95/6-31G*

States and conformations

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