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	hartrees
Energy at 0K	-193.787821
Energy at 298.15K	-193.796810
HF Energy	-193.121110
Nuclear repulsion energy	133.636744

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3235	3010	29.02
2	A'	3219	2995	27.59
3	A'	3134	2916	18.15
4	A'	3085	2870	79.19
5	A'	3069	2856	40.21
6	A'	1586	1476	0.59
7	A'	1563	1454	5.85
8	A'	1552	1444	3.54
9	A'	1529	1422	0.04
10	A'	1484	1381	36.04
11	A'	1443	1343	7.83
12	A'	1278	1189	53.01
13	A'	1206	1123	118.06
14	A'	1148	1069	2.66
15	A'	1073	999	18.90
16	A'	897	835	12.67
17	A'	477	443	0.67
18	A'	296	276	2.86
19	A"	3230	3006	28.02
20	A"	3146	2927	54.96
21	A"	3107	2891	62.31
22	A"	1543	1436	5.81
23	A"	1535	1428	4.96
24	A"	1329	1237	2.04
25	A"	1232	1147	12.04
26	A"	1196	1113	0.18
27	A"	843	784	0.01
28	A"	264	245	2.18
29	A"	210	196	2.43
30	A"	102	95	3.18

Atom	x (Å)	y (Å)	z (Å)
C1	1.322	1.239	0.000
O2	0.009	0.714	0.000
C3	0.000	-0.705	0.000
C4	-1.441	-1.174	0.000
H5	1.233	2.321	0.000
H6	1.874	0.921	0.890
H7	1.874	0.921	-0.890
H8	0.530	-1.078	-0.885
H9	0.530	-1.078	0.885
H10	-1.482	-2.263	0.000
H11	-1.957	-0.804	0.884
H12	-1.957	-0.804	-0.884

	C1	O2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12
C1		1.4143	2.3507	3.6677	1.0862	1.0943	1.0943	2.6032	2.6032	4.4862	3.9628	3.9628
O2	1.4143		1.4189	2.3799	2.0210	2.0771	2.0771	2.0649	2.0649	3.3293	2.6359	2.6359
C3	2.3507	1.4189		1.5150	3.2681	2.6358	2.6358	1.0965	1.0965	2.1505	2.1493	2.1493
C4	3.6677	2.3799	1.5150		4.4009	4.0208	4.0208	2.1619	2.1619	1.0898	1.0883	1.0883
H5	1.0862	2.0210	3.2681	4.4009		1.7784	1.7784	3.5821	3.5821	5.3284	4.5528	4.5528
H6	1.0943	2.0771	2.6358	4.0208	1.7784		1.7795	2.9920	2.4087	4.7112	4.2012	4.5603
H7	1.0943	2.0771	2.6358	4.0208	1.7784	1.7795		2.4087	2.9920	4.7112	4.5603	4.2012
H8	2.6032	2.0649	1.0965	2.1619	3.5821	2.9920	2.4087		1.7700	2.4973	3.0635	2.5012
H9	2.6032	2.0649	1.0965	2.1619	3.5821	2.4087	2.9920	1.7700		2.4973	2.5012	3.0635
H10	4.4862	3.3293	2.1505	1.0898	5.3284	4.7112	4.7112	2.4973	2.4973		1.7703	1.7703
H11	3.9628	2.6359	2.1493	1.0883	4.5528	4.2012	4.5603	3.0635	2.5012	1.7703		1.7677
H12	3.9628	2.6359	2.1493	1.0883	4.5528	4.5603	4.2012	2.5012	3.0635	1.7703	1.7677

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	C3	112.130	O2	C1	H5	107.119
O2	C1	H6	111.146	O2	C1	H7	111.146
O2	C3	C4	108.376	O2	C3	H8	109.684
O2	C3	H9	109.684	C3	C4	H10	110.235
C3	C4	H11	110.232	C3	C4	H12	110.232
C4	C3	H8	110.734	C4	C3	H9	110.734
H5	C1	H6	109.294	H5	C1	H7	109.294
H6	C1	H7	108.803	H8	C3	H9	107.624
H10	C4	H11	108.742	H10	C4	H12	108.742
H11	C4	H12	108.614

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

using model chemistry: MP3/6-31+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: MP3/6-31+G**

States and conformations

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