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	hartrees
Energy at 0K	-231.186506
Energy at 298.15K	-231.193691
Nuclear repulsion energy	174.635277

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3256	3135	10.19
2	A	3230	3109	3.36
3	A	3124	3008	40.11
4	A	3073	2959	43.45
5	A	3048	2934	42.07
6	A	3018	2905	49.42
7	A	1692	1629	61.41
8	A	1530	1473	1.13
9	A	1506	1449	0.60
10	A	1416	1363	3.46
11	A	1333	1283	1.85
12	A	1309	1260	8.25
13	A	1258	1211	9.35
14	A	1222	1177	11.84
15	A	1173	1129	75.79
16	A	1102	1060	38.62
17	A	1078	1037	7.91
18	A	1019	981	7.64
19	A	951	915	20.81
20	A	944	909	37.33
21	A	911	877	4.47
22	A	853	821	2.13
23	A	841	810	5.99
24	A	715	689	43.15
25	A	689	664	2.83
26	A	458	441	24.65
27	A	107	103	1.29

Atom	x (Å)	y (Å)	z (Å)
H1	0.962	2.110	0.091
C2	0.526	1.122	0.050
H3	2.262	-0.213	0.020
C4	1.196	-0.027	0.009
O5	0.433	-1.150	-0.076
H6	-1.350	1.140	-1.036
H7	-1.555	1.291	0.707
C8	-0.947	0.815	-0.068
H9	-1.535	-1.244	-0.668
H10	-1.267	-1.031	1.076
C11	-0.939	-0.719	0.079

	H1	C2	H3	C4	O5	H6	H7	C8	H9	H10	C11
H1		1.0809	2.6633	2.1510	3.3062	2.7493	2.7177	2.3119	4.2497	3.9750	3.4081
C2	1.0809		2.1905	1.3302	2.2765	2.1681	2.1888	1.5087	3.2186	2.9832	2.3524
H3	2.6633	2.1905		1.0828	2.0570	3.9999	4.1601	3.3708	3.9948	3.7734	3.2413
C4	2.1510	1.3302	1.0828		1.3598	2.9895	3.1289	2.3031	3.0658	2.8655	2.2450
O5	3.3062	2.2765	2.0570	1.3598		3.0568	3.2437	2.4005	2.0579	2.0574	1.4464
H6	2.7493	2.1681	3.9999	2.9895	3.0568		1.7619	1.0980	2.4189	3.0300	2.2065
H7	2.7177	2.1888	4.1601	3.1289	3.2437	1.7619		1.0946	2.8836	2.3680	2.1938
C8	2.3119	1.5087	3.3708	2.3031	2.4005	1.0980	1.0946		2.2236	2.1951	1.5409
H9	4.2497	3.2186	3.9948	3.0658	2.0579	2.4189	2.8836	2.2236		1.7779	1.0908
H10	3.9750	2.9832	3.7734	2.8655	2.0574	3.0300	2.3680	2.1951	1.7779		1.0950
C11	3.4081	2.3524	3.2413	2.2450	1.4464	2.2065	2.1938	1.5409	1.0908	1.0950

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	C2	C4	125.969	H1	C2	C8	125.635
C2	C4	H3	130.125	C2	C4	O5	115.617
C2	C8	H6	111.582	C2	C8	H7	113.490
C2	C8	C11	100.952	H3	C4	O5	114.253
C4	C2	C8	108.271	C4	O5	C11	106.226
O5	C11	C8	106.907	O5	C11	H9	107.579
O5	C11	H10	107.295	H6	C8	H7	106.947
H6	C8	C11	112.386	H7	C8	C11	111.576
C8	C11	H9	114.240	C8	C11	H10	111.649
H9	C11	H10	108.852

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

using model chemistry: B3PW91/6-311G*

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	0.205
2	C	-0.328
3	H	0.220
4	C	0.023
5	O	-0.315
6	H	0.228
7	H	0.229
8	C	-0.475
9	H	0.224
10	H	0.219
11	C	-0.231

	x	y	z	Total
	-0.775	0.867	0.108	1.168
CHELPG
AIM
ESP

	x	y	z
x	0.000	0.000	0.000
y	0.000	0.000	0.000
z	0.000	0.000	0.000

<r²>	93.751
(<r²>)^1/2	9.683

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

using model chemistry: B3PW91/6-311G*

States and conformations

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