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	hartrees
Energy at 0K	-228.717257
Energy at 298.15K	-228.724271
Nuclear repulsion energy	172.618466

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3224	3166	1.52
2	A	3189	3132	0.55
3	A	3069	3014	20.70
4	A	3026	2972	11.92
5	A	3003	2949	25.74
6	A	2981	2927	24.54
7	A	1654	1624	36.81
8	A	1503	1476	3.37
9	A	1479	1452	1.86
10	A	1353	1328	4.00
11	A	1281	1258	6.50
12	A	1269	1246	17.30
13	A	1228	1206	10.56
14	A	1172	1151	1.35
15	A	1146	1126	41.23
16	A	1059	1040	46.65
17	A	1044	1026	0.85
18	A	994	976	1.08
19	A	931	915	18.52
20	A	906	890	23.97
21	A	904	888	9.93
22	A	840	825	0.92
23	A	821	806	3.30
24	A	703	690	42.20
25	A	690	678	12.16
26	A	455	447	29.46
27	A	55	54	1.16

Atom	x (Å)	y (Å)	z (Å)
H1	0.948	2.131	0.051
C2	0.528	1.128	0.030
H3	2.288	-0.188	0.011
C4	1.212	-0.017	0.005
O5	0.450	-1.173	-0.042
H6	-1.395	1.186	-0.988
H7	-1.517	1.274	0.795
C8	-0.952	0.823	-0.040
H9	-1.513	-1.201	-0.782
H10	-1.363	-1.077	1.011
C11	-0.963	-0.724	0.045

	H1	C2	H3	C4	O5	H6	H7	C8	H9	H10	C11
H1		1.0869	2.6786	2.1646	3.3421	2.7310	2.7134	2.3079	4.2250	4.0685	3.4354
C2	1.0869		2.1976	1.3343	2.3035	2.1764	2.1886	1.5128	3.2019	3.0665	2.3782
H3	2.6786	2.1976		1.0892	2.0855	4.0554	4.1510	3.3942	4.0126	3.8880	3.2947
C4	2.1646	1.3343	1.0892		1.3851	3.0378	3.1210	2.3218	3.0737	2.9608	2.2874
O5	3.3421	2.3035	2.0855	1.3851		3.1403	3.2493	2.4390	2.0982	2.0984	1.4849
H6	2.7310	2.1764	4.0554	3.0378	3.1403		1.7892	1.1071	2.3989	3.0197	2.2138
H7	2.7134	2.1886	4.1510	3.1210	3.2493	1.7892		1.1049	2.9351	2.3667	2.2057
C8	2.3079	1.5128	3.3942	2.3218	2.4390	1.1071	1.1049		2.2277	2.2104	1.5498
H9	4.2250	3.2019	4.0126	3.0737	2.0982	2.3989	2.9351	2.2277		1.8034	1.1013
H10	4.0685	3.0665	3.8880	2.9608	2.0984	3.0197	2.3667	2.2104	1.8034		1.1040
C11	3.4354	2.3782	3.2947	2.2874	1.4849	2.2138	2.2057	1.5498	1.1013	1.1040

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	C2	C4	126.462	H1	C2	C8	124.371
C2	C4	H3	129.863	C2	C4	O5	115.778
C2	C8	H6	111.406	C2	C8	H7	112.523
C2	C8	C11	101.879	H3	C4	O5	114.359
C4	C2	C8	109.112	C4	O5	C11	105.640
O5	C11	C8	106.954	O5	C11	H9	107.525
O5	C11	H10	107.388	H6	C8	H7	107.974
H6	C8	C11	111.785	H7	C8	C11	111.272
C8	C11	H9	113.256	C8	C11	H10	111.699
H9	C11	H10	109.724

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

using model chemistry: LSDA/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	H	0.200
2	C	-0.262
3	H	0.234
4	C	0.050
5	O	-0.423
6	H	0.232
7	H	0.231
8	C	-0.491
9	H	0.237
10	H	0.235
11	C	-0.243

	x	y	z	Total
	-0.910	0.941	0.066	1.310
CHELPG
AIM
ESP

	x	y	z
x	6.687	-0.103	0.025
y	-0.103	6.686	0.003
z	0.025	0.003	3.823

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: LSDA/3-21G*

States and conformations

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