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	hartrees
Energy at 0K	-231.309057
Energy at 298.15K	-231.316253
HF Energy	-231.309057
Nuclear repulsion energy	174.222836

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3218	3113	6.96
2	A₁	2983	2886	5.45
3	A₁	1683	1628	0.11
4	A₁	1522	1473	2.06
5	A₁	1388	1343	2.98
6	A₁	1118	1082	0.94
7	A₁	989	957	7.99
8	A₁	902	873	22.66
9	A₁	753	729	6.67
10	A₂	2994	2896	0.00
11	A₂	1224	1184	0.00
12	A₂	1064	1029	0.00
13	A₂	959	928	0.00
14	A₂	405	392	0.00
15	B₁	2995	2898	80.61
16	B₁	1181	1142	2.26
17	B₁	1027	994	16.87
18	B₁	680	658	39.34
19	B₁	118	114	8.68
20	B₂	3195	3091	3.16
21	B₂	2979	2882	152.29
22	B₂	1513	1464	0.46
23	B₂	1373	1328	5.23
24	B₂	1334	1290	0.63
25	B₂	1099	1063	100.18
26	B₂	918	888	0.18
27	B₂	814	788	3.23

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	1.186
C2	0.000	1.173	0.369
C3	0.000	0.662	-1.041
C4	0.000	-0.662	-1.041
C5	0.000	-1.173	0.369
H6	0.884	1.781	0.596
H7	-0.884	1.781	0.596
H8	-0.884	-1.781	0.596
H9	0.884	-1.781	0.596
H10	0.000	1.309	-1.905
H11	0.000	-1.309	-1.905

	O1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11
O1		1.4297	2.3231	2.3231	1.4297	2.0741	2.0741	2.0741	2.0741	3.3570	3.3570
C2	1.4297		1.4991	2.3140	2.3461	1.0970	1.0970	3.0920	3.0920	2.2781	3.3661
C3	2.3231	1.4991		1.3245	2.3140	2.1711	2.1711	3.0712	3.0712	1.0797	2.1524
C4	2.3231	2.3140	1.3245		1.4991	3.0712	3.0712	2.1711	2.1711	2.1524	1.0797
C5	1.4297	2.3461	2.3140	1.4991		3.0920	3.0920	1.0970	1.0970	3.3661	2.2781
H6	2.0741	1.0970	2.1711	3.0712	3.0920		1.7684	3.9770	3.5622	2.6951	4.0729
H7	2.0741	1.0970	2.1711	3.0712	3.0920	1.7684		3.5622	3.9770	2.6951	4.0729
H8	2.0741	3.0920	3.0712	2.1711	1.0970	3.9770	3.5622		1.7684	4.0729	2.6951
H9	2.0741	3.0920	3.0712	2.1711	1.0970	3.5622	3.9770	1.7684		4.0729	2.6951
H10	3.3570	2.2781	1.0797	2.1524	3.3661	2.6951	2.6951	4.0729	4.0729		2.6176
H11	3.3570	3.3661	2.1524	1.0797	2.2781	4.0729	4.0729	2.6951	2.6951	2.6176

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	104.948	O1	C2	H6	109.640
O1	C2	H7	109.640	O1	C5	C4	104.948
O1	C5	H8	109.640	O1	C5	H9	109.640
C2	O1	C5	110.262	C2	C3	C4	109.921
C2	C3	H10	123.294	C3	C2	H6	112.584
C3	C2	H7	112.584	C3	C4	C5	109.921
C3	C4	H11	126.785	C4	C3	H10	126.785
C4	C5	H8	112.584	C4	C5	H9	112.584
C5	C4	H11	123.294	H6	C2	H7	107.415
H8	C5	H9	107.415

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

using model chemistry: B3LYP/aug-cc-pVTZ

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

using model chemistry: B3LYP/aug-cc-pVTZ

States and conformations

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