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	hartrees
Energy at 0K	-193.750598
Energy at 298.15K	-193.759579
HF Energy	-193.120644
Nuclear repulsion energy	133.500864

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3238	3046	24.65
2	A'	3223	3031	22.09
3	A'	3127	2942	17.14
4	A'	3073	2891	79.65
5	A'	3057	2875	45.97
6	A'	1574	1480	0.43
7	A'	1554	1462	5.09
8	A'	1546	1454	4.84
9	A'	1512	1423	0.00
10	A'	1467	1380	32.92
11	A'	1428	1343	8.25
12	A'	1256	1182	39.65
13	A'	1179	1109	125.31
14	A'	1141	1073	5.47
15	A'	1057	995	20.91
16	A'	883	830	15.09
17	A'	471	443	0.63
18	A'	293	276	3.01
19	A"	3237	3044	22.25
20	A"	3146	2959	50.51
21	A"	3104	2920	63.26
22	A"	1535	1444	6.41
23	A"	1528	1437	5.63
24	A"	1318	1240	1.51
25	A"	1221	1148	11.35
26	A"	1186	1115	0.14
27	A"	841	791	0.05
28	A"	268	252	2.16
29	A"	215	202	2.23
30	A"	105	98	3.32

Atom	x (Å)	y (Å)	z (Å)
C1	1.324	1.238	0.000
O2	0.003	0.717	0.000
C3	0.000	-0.707	0.000
C4	-1.438	-1.175	0.000
H5	1.236	2.321	0.000
H6	1.874	0.917	0.891
H7	1.874	0.917	-0.891
H8	0.532	-1.077	-0.887
H9	0.532	-1.077	0.887
H10	-1.480	-2.265	0.000
H11	-1.953	-0.805	0.884
H12	-1.953	-0.805	-0.884

	C1	O2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12
C1		1.4200	2.3534	3.6674	1.0866	1.0950	1.0950	2.6023	2.6023	4.4867	3.9619	3.9619
O2	1.4200		1.4244	2.3780	2.0234	2.0816	2.0816	2.0694	2.0694	3.3299	2.6317	2.6317
C3	2.3534	1.4244		1.5117	3.2713	2.6351	2.6351	1.0977	1.0977	2.1482	2.1464	2.1464
C4	3.6674	2.3780	1.5117		4.4014	4.0169	4.0169	2.1620	2.1620	1.0904	1.0885	1.0885
H5	1.0866	2.0234	3.2713	4.4014		1.7810	1.7810	3.5816	3.5816	5.3297	4.5527	4.5527
H6	1.0950	2.0816	2.6351	4.0169	1.7810		1.7816	2.9891	2.4033	4.7078	4.1966	4.5567
H7	1.0950	2.0816	2.6351	4.0169	1.7810	1.7816		2.4033	2.9891	4.7078	4.5567	4.1966
H8	2.6023	2.0694	1.0977	2.1620	3.5816	2.9891	2.4033		1.7730	2.4988	3.0635	2.4998
H9	2.6023	2.0694	1.0977	2.1620	3.5816	2.4033	2.9891	1.7730		2.4988	2.4998	3.0635
H10	4.4867	3.3299	2.1482	1.0904	5.3297	4.7078	4.7078	2.4988	2.4988		1.7710	1.7710
H11	3.9619	2.6317	2.1464	1.0885	4.5527	4.1966	4.5567	3.0635	2.4998	1.7710		1.7689
H12	3.9619	2.6317	2.1464	1.0885	4.5527	4.5567	4.1966	2.4998	3.0635	1.7710	1.7689

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	C3	111.661	O2	C1	H5	106.900
O2	C1	H6	111.065	O2	C1	H7	111.065
O2	C3	C4	108.134	O2	C3	H8	109.587
O2	C3	H9	109.587	C3	C4	H10	110.235
C3	C4	H11	110.204	C3	C4	H12	110.204
C4	C3	H8	110.898	C4	C3	H9	110.898
H5	C1	H6	109.446	H5	C1	H7	109.446
H6	C1	H7	108.885	H8	C3	H9	107.729
H10	C4	H11	108.735	H10	C4	H12	108.735
H11	C4	H12	108.683

All results from a given calculation for CH₃OC₂H₅ (Ethane, methoxy-)

using model chemistry: MP2/6-31+G**

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 CH3OC2H5 (Ethane, methoxy-)

using model chemistry: MP2/6-31+G**

States and conformations

All results from a given calculation for CH₃OC₂H₅ (Ethane, methoxy-)