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	hartrees
Energy at 0K	-230.931750
Energy at 298.15K	-230.938795
Nuclear repulsion energy	173.170201

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3204	3158	7.38
2	A	3174	3129	4.74
3	A	3058	3015	34.19
4	A	3009	2966	35.49
5	A	2981	2938	41.14
6	A	2952	2909	45.89
7	A	1651	1627	53.36
8	A	1494	1472	0.18
9	A	1473	1452	0.12
10	A	1378	1358	3.00
11	A	1295	1276	2.76
12	A	1272	1254	6.41
13	A	1216	1198	9.87
14	A	1181	1164	10.99
15	A	1142	1126	56.61
16	A	1071	1056	33.08
17	A	1045	1030	5.84
18	A	993	979	4.22
19	A	926	913	15.77
20	A	916	903	32.57
21	A	863	851	4.62
22	A	827	816	2.35
23	A	817	805	5.00
24	A	683	674	28.84
25	A	666	656	3.41
26	A	439	433	21.98
27	A	107	105	1.13

Atom	x (Å)	y (Å)	z (Å)
H1	0.771	2.207	0.091
C2	0.425	1.174	0.051
H3	2.290	-0.017	0.018
C4	1.202	0.079	0.009
O5	0.540	-1.120	-0.076
H6	-1.457	1.025	-1.047
H7	-1.679	1.157	0.711
C8	-1.021	0.735	-0.069
H9	-1.431	-1.383	-0.675
H10	-1.182	-1.144	1.086
C11	-0.878	-0.802	0.079

	H1	C2	H3	C4	O5	H6	H7	C8	H9	H10	C11
H1		1.0895	2.6939	2.1728	3.3389	2.7669	2.7363	2.3245	4.2800	4.0042	3.4306
C2	1.0895		2.2137	1.3443	2.3009	2.1838	2.2046	1.5159	3.2419	3.0046	2.3670
H3	2.6939	2.2137		1.0921	2.0709	4.0324	4.1966	3.3966	4.0242	3.8034	3.2647
C4	2.1728	1.3443	1.0921		1.3722	3.0134	3.1555	2.3195	3.0884	2.8879	2.2602
O5	3.3389	2.3009	2.0709	1.3722		3.0871	3.2756	2.4245	2.0769	2.0773	1.4619
H6	2.7669	2.1838	4.0324	3.0134	3.0871		1.7768	1.1085	2.4357	3.0539	2.2220
H7	2.7363	2.2046	4.1966	3.1555	3.2756	1.7768		1.1048	2.9042	2.3843	2.2084
C8	2.3245	1.5159	3.3966	2.3195	2.4245	1.1085	1.1048		2.2402	2.2118	1.5502
H9	4.2800	3.2419	4.0242	3.0884	2.0769	2.4357	2.9042	2.2402		1.7941	1.1012
H10	4.0042	3.0046	3.8034	2.8879	2.0773	3.0539	2.3843	2.2118	1.7941		1.1055
C11	3.4306	2.3670	3.2647	2.2602	1.4619	2.2220	2.2084	1.5502	1.1012	1.1055

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	C2	C4	126.119	H1	C2	C8	125.506
C2	C4	H3	130.338	C2	C4	O5	115.778
C2	C8	H6	111.694	C2	C8	H7	113.612
C2	C8	C11	101.060	H3	C4	O5	113.879
C4	C2	C8	108.231	C4	O5	C11	105.739
O5	C11	C8	107.167	O5	C11	H9	107.419
O5	C11	H10	107.194	H6	C8	H7	106.793
H6	C8	C11	112.325	H7	C8	C11	111.464
C8	C11	H9	114.261	C8	C11	H10	111.687
H9	C11	H10	108.784

All results from a given calculation for C₄H₆O (Furan, 2,3-dihydro-)

using model chemistry: PBEPBE/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	H	0.140
2	C	-0.200
3	H	0.153
4	C	0.110
5	O	-0.418
6	H	0.165
7	H	0.164
8	C	-0.356
9	H	0.166
10	H	0.163
11	C	-0.087

	x	y	z	Total
	-0.818	0.709	0.106	1.087
CHELPG
AIM
ESP

	x	y	z
x	7.209	-0.158	0.048
y	-0.158	7.114	0.006
z	0.048	0.006	4.372

<r²>	94.834
(<r²>)^1/2	9.738

All results from a given calculation for C4H6O (Furan, 2,3-dihydro-)

using model chemistry: PBEPBE/6-31G*

States and conformations

All results from a given calculation for C₄H₆O (Furan, 2,3-dihydro-)