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	hartrees
Energy at 0K	-229.861647
Energy at 298.15K	-229.868823
Nuclear repulsion energy	171.959661

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3263	3136	5.40
2	A₁	3022	2905	9.13
3	A₁	1696	1630	0.63
4	A₁	1575	1514	0.53
5	A₁	1376	1322	0.14
6	A₁	1153	1108	1.95
7	A₁	980	942	6.57
8	A₁	873	839	9.51
9	A₁	743	714	6.40
10	A₂	3042	2924	0.00
11	A₂	1218	1171	0.00
12	A₂	1079	1037	0.00
13	A₂	977	939	0.00
14	A₂	389	374	0.00
15	B₁	3048	2929	94.49
16	B₁	1174	1128	11.20
17	B₁	1019	979	10.08
18	B₁	702	674	48.97
19	B₁	126	121	10.47
20	B₂	3235	3109	0.98
21	B₂	3015	2898	114.08
22	B₂	1560	1500	1.55
23	B₂	1369	1316	3.32
24	B₂	1332	1280	0.68
25	B₂	1073	1031	74.01
26	B₂	908	873	0.01
27	B₂	817	785	2.52

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	1.222
C2	0.000	1.194	0.365
C3	0.000	0.666	-1.052
C4	0.000	-0.666	-1.052
C5	0.000	-1.194	0.365
H6	0.892	1.801	0.575
H7	-0.892	1.801	0.575
H8	-0.892	-1.801	0.575
H9	0.892	-1.801	0.575
H10	0.000	1.313	-1.919
H11	0.000	-1.313	-1.919

	O1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11
O1		1.4694	2.3691	2.3691	1.4694	2.1118	2.1118	2.1118	2.1118	3.4044	3.4044
C2	1.4694		1.5126	2.3380	2.3879	1.0998	1.0998	3.1326	3.1326	2.2876	3.3918
C3	2.3691	1.5126		1.3311	2.3380	2.1758	2.1758	3.0871	3.0871	1.0823	2.1603
C4	2.3691	2.3380	1.3311		1.5126	3.0871	3.0871	2.1758	2.1758	2.1603	1.0823
C5	1.4694	2.3879	2.3380	1.5126		3.1326	3.1326	1.0998	1.0998	3.3918	2.2876
H6	2.1118	1.0998	2.1758	3.0871	3.1326		1.7849	4.0208	3.6029	2.6939	4.0888
H7	2.1118	1.0998	2.1758	3.0871	3.1326	1.7849		3.6029	4.0208	2.6939	4.0888
H8	2.1118	3.1326	3.0871	2.1758	1.0998	4.0208	3.6029		1.7849	4.0888	2.6939
H9	2.1118	3.1326	3.0871	2.1758	1.0998	3.6029	4.0208	1.7849		4.0888	2.6939
H10	3.4044	2.2876	1.0823	2.1603	3.3918	2.6939	2.6939	4.0888	4.0888		2.6261
H11	3.4044	3.3918	2.1603	1.0823	2.2876	4.0888	4.0888	2.6939	2.6939	2.6261

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	105.205	O1	C2	H6	109.732
O1	C2	H7	109.732	O1	C5	C4	105.205
O1	C5	H8	109.732	O1	C5	H9	109.732
C2	O1	C5	108.696	C2	C3	C4	110.447
C2	C3	H10	122.806	C3	C2	H6	111.824
C3	C2	H7	111.824	C3	C4	C5	110.447
C3	C4	H11	126.746	C4	C3	H10	126.746
C4	C5	H8	111.824	C4	C5	H9	111.824
C5	C4	H11	122.806	H6	C2	H7	108.480
H8	C5	H9	108.480

All results from a given calculation for C₄H₆O (Furan, 2,5-dihydro-)

using model chemistry: B3PW91/3-21G

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
1	O	-0.486
2	C	-0.188
3	C	-0.233
4	C	-0.233
5	C	-0.188
6	H	0.222
7	H	0.222
8	H	0.222
9	H	0.222
10	H	0.220
11	H	0.220

<r²>	95.915
(<r²>)^1/2	9.794

All results from a given calculation for C4H6O (Furan, 2,5-dihydro-)

using model chemistry: B3PW91/3-21G

States and conformations

All results from a given calculation for C₄H₆O (Furan, 2,5-dihydro-)