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	hartrees
Energy at 0K	-229.804653
Energy at 298.15K	-229.812117
Nuclear repulsion energy	175.326073

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3389	3077	8.81
2	A₁	3169	2878	18.94
3	A₁	1847	1678	0.19
4	A₁	1640	1489	0.43
5	A₁	1528	1388	13.27
6	A₁	1196	1086	1.38
7	A₁	1059	962	21.82
8	A₁	1011	918	16.54
9	A₁	813	738	8.01
10	A₂	3193	2900	0.00
11	A₂	1322	1200	0.00
12	A₂	1158	1052	0.00
13	A₂	1057	960	0.00
14	A₂	424	385	0.00
15	B₁	3197	2903	136.41
16	B₁	1288	1169	0.70
17	B₁	1126	1023	29.08
18	B₁	753	684	32.68
19	B₁	138	126	9.04
20	B₂	3361	3052	4.40
21	B₂	3162	2871	172.56
22	B₂	1628	1478	3.59
23	B₂	1494	1357	3.26
24	B₂	1431	1299	0.98
25	B₂	1263	1146	139.43
26	B₂	979	889	0.17
27	B₂	877	797	1.64

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	1.170
C2	0.000	1.162	0.377
C3	0.000	0.659	-1.040
C4	0.000	-0.659	-1.040
C5	0.000	-1.162	0.377
H6	0.883	1.768	0.603
H7	-0.883	1.768	0.603
H8	-0.883	-1.768	0.603
H9	0.883	-1.768	0.603
H10	0.000	1.308	-1.905
H11	0.000	-1.308	-1.905

	O1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11
O1		1.4069	2.3064	2.3064	1.4069	2.0558	2.0558	2.0558	2.0558	3.3414	3.3414
C2	1.4069		1.5035	2.3072	2.3238	1.0946	1.0946	3.0681	3.0681	2.2859	3.3625
C3	2.3064	1.5035		1.3180	2.3072	2.1699	2.1699	3.0607	3.0607	1.0811	2.1488
C4	2.3064	2.3072	1.3180		1.5035	3.0607	3.0607	2.1699	2.1699	2.1488	1.0811
C5	1.4069	2.3238	2.3072	1.5035		3.0681	3.0681	1.0946	1.0946	3.3625	2.2859
H6	2.0558	1.0946	2.1699	3.0607	3.0681		1.7666	3.9519	3.5351	2.6978	4.0655
H7	2.0558	1.0946	2.1699	3.0607	3.0681	1.7666		3.5351	3.9519	2.6978	4.0655
H8	2.0558	3.0681	3.0607	2.1699	1.0946	3.9519	3.5351		1.7666	4.0655	2.6978
H9	2.0558	3.0681	3.0607	2.1699	1.0946	3.5351	3.9519	1.7666		4.0655	2.6978
H10	3.3414	2.2859	1.0811	2.1488	3.3625	2.6978	2.6978	4.0655	4.0655		2.6166
H11	3.3414	3.3625	2.1488	1.0811	2.2859	4.0655	4.0655	2.6978	2.6978	2.6166

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	104.783	O1	C2	H6	109.903
O1	C2	H7	109.903	O1	C5	C4	104.783
O1	C5	H8	109.903	O1	C5	H9	109.903
C2	O1	C5	111.349	C2	C3	C4	109.543
C2	C3	H10	123.543	C3	C2	H6	112.320
C3	C2	H7	112.320	C3	C4	C5	109.543
C3	C4	H11	126.914	C4	C3	H10	126.914
C4	C5	H8	112.320	C4	C5	H9	112.320
C5	C4	H11	123.543	H6	C2	H7	107.601
H8	C5	H9	107.601

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

using model chemistry: HF/cc-pVDZ

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	-0.503
2	C	0.302
3	C	-0.140
4	C	-0.140
5	C	0.302
6	H	0.031
7	H	0.031
8	H	0.031
9	H	0.031
10	H	0.027
11	H	0.027

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: HF/cc-pVDZ

States and conformations

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