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	hartrees
Energy at 0K	-232.845644
Energy at 298.15K	-232.856936
HF Energy	-232.143125
Nuclear repulsion energy	189.932782

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3208	3025	27.09
2	A₁	3117	2940	3.76
3	A₁	3043	2870	89.58
4	A₁	1603	1511	0.16
5	A₁	1566	1477	4.78
6	A₁	1501	1415	5.75
7	A₁	1452	1370	0.63
8	A₁	1216	1146	17.47
9	A₁	1095	1033	12.13
10	A₁	884	833	7.63
11	A₁	450	425	0.11
12	A₁	198	186	0.74
13	A₂	3220	3037	0.00
14	A₂	3083	2907	0.00
15	A₂	1549	1461	0.00
16	A₂	1329	1253	0.00
17	A₂	1211	1142	0.00
18	A₂	843	795	0.00
19	A₂	268	253	0.00
20	A₂	98	93	0.00
21	B₁	3220	3037	39.86
22	B₁	3080	2904	115.45
23	B₁	1549	1461	10.37
24	B₁	1335	1259	1.69
25	B₁	1244	1173	12.80
26	B₁	857	808	0.72
27	B₁	275	259	1.76
28	B₁	112	106	4.75
29	B₂	3208	3025	13.82
30	B₂	3117	2940	23.50
31	B₂	3035	2862	7.29
32	B₂	1585	1495	3.30
33	B₂	1564	1475	2.58
34	B₂	1471	1387	37.33
35	B₂	1421	1340	50.16
36	B₂	1196	1128	171.43
37	B₂	1139	1074	3.21
38	B₂	979	923	5.83
39	B₂	442	416	3.76

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.332
C2	0.000	1.194	-0.526
C3	0.000	-1.194	-0.526
C4	0.000	2.410	0.384
C5	0.000	-2.410	0.384
H6	0.870	1.182	-1.137
H7	-0.870	1.182	-1.137
H8	0.870	-1.182	-1.137
H9	-0.870	-1.182	-1.137
H10	0.000	3.294	-0.210
H11	0.000	-3.294	-0.210
H12	-0.870	2.394	1.005
H13	0.870	2.394	1.005
H14	0.870	-2.394	1.005
H15	-0.870	-2.394	1.005

	O1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12	H13	H14	H15
O1		1.4703	1.4703	2.4106	2.4106	2.0765	2.0765	2.0765	2.0765	3.3387	3.3387	2.6341	2.6341	2.6341	2.6341
C2	1.4703		2.3880	1.5190	3.7172	1.0630	1.0630	2.6028	2.6028	2.1241	4.4995	2.1305	2.1305	3.9963	3.9963
C3	1.4703	2.3880		3.7172	1.5190	2.6028	2.6028	1.0630	1.0630	4.4995	2.1241	3.9963	3.9963	2.1305	2.1305
C4	2.4106	1.5190	3.7172		4.8200	2.1401	2.1401	3.9966	3.9966	1.0655	5.7353	1.0685	1.0685	4.9210	4.9210
C5	2.4106	3.7172	1.5190	4.8200		3.9966	3.9966	2.1401	2.1401	5.7353	1.0655	4.9210	4.9210	1.0685	1.0685
H6	2.0765	1.0630	2.6028	2.1401	3.9966		1.7392	2.3637	2.9346	2.4656	4.6533	3.0137	2.4611	4.1681	4.5164
H7	2.0765	1.0630	2.6028	2.1401	3.9966	1.7392		2.9346	2.3637	2.4656	4.6533	2.4611	3.0137	4.5164	4.1681
H8	2.0765	2.6028	1.0630	3.9966	2.1401	2.3637	2.9346		1.7392	4.6533	2.4656	4.5164	4.1681	2.4611	3.0137
H9	2.0765	2.6028	1.0630	3.9966	2.1401	2.9346	2.3637	1.7392		4.6533	2.4656	4.1681	4.5164	3.0137	2.4611
H10	3.3387	2.1241	4.4995	1.0655	5.7353	2.4656	2.4656	4.6533	4.6533		6.5889	1.7446	1.7446	5.8810	5.8810
H11	3.3387	4.4995	2.1241	5.7353	1.0655	4.6533	4.6533	2.4656	2.4656	6.5889		5.8810	5.8810	1.7446	1.7446
H12	2.6341	2.1305	3.9963	1.0685	4.9210	3.0137	2.4611	4.5164	4.1681	1.7446	5.8810		1.7394	5.0934	4.7872
H13	2.6341	2.1305	3.9963	1.0685	4.9210	2.4611	3.0137	4.1681	4.5164	1.7446	5.8810	1.7394		4.7872	5.0934
H14	2.6341	3.9963	2.1305	4.9210	1.0685	4.1681	4.5164	2.4611	3.0137	5.8810	1.7446	5.0934	4.7872		1.7394
H15	2.6341	3.9963	2.1305	4.9210	1.0685	4.5164	4.1681	3.0137	2.4611	5.8810	1.7446	4.7872	5.0934	1.7394

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C4	107.483	O1	C2	H6	109.045
O1	C2	H7	109.045	O1	C3	C5	107.483
O1	C3	H8	109.045	O1	C3	H9	109.045
C2	O1	C3	108.602	C2	C4	H10	109.284
C2	C4	H12	109.617	C2	C4	H13	109.617
C3	C5	H11	109.284	C3	C5	H14	109.617
C3	C5	H15	109.617	C4	C2	H6	110.717
C4	C2	H7	110.717	C5	C3	H8	110.717
C5	C3	H9	110.717	H6	C2	H7	109.776
H8	C3	H9	109.776	H10	C4	H12	109.674
H10	C4	H13	109.674	H11	C5	H14	109.674
H11	C5	H15	109.674	H12	C4	H13	108.962
H14	C5	H15	108.962

All results from a given calculation for C₄H₁₀O (Ethoxy ethane)

using model chemistry: MP2/6-31G*

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 C4H10O (Ethoxy ethane)

using model chemistry: MP2/6-31G*

States and conformations

All results from a given calculation for C₄H₁₀O (Ethoxy ethane)