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	hartrees
Energy at 0K	-228.079530
Energy at 298.15K	-228.088040
Nuclear repulsion energy	178.922718

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3828	3126	0.36
2	A	3762	3072	0.01
3	A	3737	3051	0.33
4	A	3720	3037	0.91
5	A	3697	3018	5.71
6	A	3667	2994	43.34
7	A	3567	2913	0.69
8	A	3527	2880	6.92
9	A	2068	1688	39.96
10	A	1827	1492	0.24
11	A	1820	1486	8.69
12	A	1815	1482	3.64
13	A	1810	1478	2.00
14	A	1756	1434	14.17
15	A	1725	1409	4.29
16	A	1687	1377	15.10
17	A	1562	1276	75.46
18	A	1378	1125	1.50
19	A	1334	1089	11.38
20	A	1305	1065	5.69
21	A	1260	1029	2.31
22	A	1201	981	3.03
23	A	1101	899	25.64
24	A	1090	890	1.54
25	A	934	762	3.15
26	A	880	718	2.39
27	A	639	522	0.64
28	A	501	409	5.73
29	A	451	368	0.20
30	A	338	276	0.67
31	A	231	188	1.20
32	A	186	152	0.61
33	A	63	52	4.99

Atom	x (Å)	y (Å)	z (Å)
C1	1.806	-0.015	0.253
H2	1.695	-0.093	1.339
H3	2.709	-0.554	-0.041
H4	1.936	1.039	-0.008
O5	0.714	-0.625	-0.453
C6	-0.724	1.407	-0.046
H7	-0.224	1.859	0.807
H8	-0.318	1.850	-0.951
H9	-1.780	1.646	0.015
C10	-0.541	-0.113	-0.063
C11	-1.517	-0.961	0.176
H12	-2.518	-0.626	0.397
H13	-1.352	-2.027	0.144

	C1	H2	H3	H4	O5	C6	H7	H8	H9	C10	C11	H12	H13
C1		1.0943	1.0916	1.0933	1.4367	2.9181	2.8181	3.0727	3.9598	2.3706	3.4561	4.3697	3.7461
H2	1.0943		1.7731	1.7756	2.1109	3.1656	2.7889	3.6157	4.1058	2.6393	3.5247	4.3500	3.8015
H3	1.0916	1.7731		1.7702	2.0385	3.9538	3.8916	3.9711	4.9996	3.2800	4.2510	5.2458	4.3236
H4	1.0933	1.7756	1.7702		2.1124	2.6865	2.4506	2.5752	3.7663	2.7328	3.9949	4.7727	4.4983
O5	1.4367	2.1109	2.0385	2.1124		2.5228	2.9393	2.7278	3.4055	1.4104	2.3417	3.3415	2.5664
C6	2.9181	3.1656	3.9538	2.6865	2.5228		1.0871	1.0870	1.0844	1.5310	2.5071	2.7471	3.4963
H7	2.8181	2.7889	3.8916	2.4506	2.9393	1.0871		1.7609	1.7595	2.1786	3.1661	3.4070	4.1008
H8	3.0727	3.6157	3.9711	2.5752	2.7278	1.0870	1.7609		1.7644	2.1661	3.2574	3.5760	4.1595
H9	3.9598	4.1058	4.9996	3.7663	3.4055	1.0844	1.7595	1.7644		2.1529	2.6253	2.4190	3.7005
C10	2.3706	2.6393	3.2800	2.7328	1.4104	1.5310	2.1786	2.1661	2.1529		1.3148	2.0935	2.0892
C11	3.4561	3.5247	4.2510	3.9949	2.3417	2.5071	3.1661	3.2574	2.6253	1.3148		1.0785	1.0795
H12	4.3697	4.3500	5.2458	4.7727	3.3415	2.7471	3.4070	3.5760	2.4190	2.0935	1.0785		1.8408
H13	3.7461	3.8015	4.3236	4.4983	2.5664	3.4963	4.1008	4.1595	3.7005	2.0892	1.0795	1.8408

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O5	C10	112.735	H2	C1	H3	108.420
H2	C1	H4	108.522	H2	C1	O5	112.318
H3	C1	H4	108.235	H3	C1	O5	106.672
H4	C1	O5	112.513	O5	C10	C6	118.057
O5	C10	C11	118.426	C6	C10	C11	123.341
H7	C6	H8	108.176	H7	C6	H9	108.250
H7	C6	C10	111.513	H8	C6	H9	108.688
H8	C6	C10	110.514	H9	C6	C10	109.622
C10	C11	H12	121.710	C10	C11	H13	121.207
H12	C11	H13	117.076

All results from a given calculation for CH₂C(CH₃)OCH₃ (1-Propene, 2-methoxy-)

using model chemistry: HF/STO-3G

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	C	-0.064
2	H	0.061
3	H	0.074
4	H	0.061
5	O	-0.240
6	C	-0.197
7	H	0.068
8	H	0.072
9	H	0.073
10	C	0.128
11	C	-0.165
12	H	0.060
13	H	0.068

	x	y	z	Total
	0.261	1.281	0.827	1.547
CHELPG
AIM
ESP

	x	y	z
x	5.239	0.885	-0.319
y	0.885	4.018	-0.139
z	-0.319	-0.139	2.083

<r²>	128.000
(<r²>)^1/2	11.314

All results from a given calculation for CH2C(CH3)OCH3 (1-Propene, 2-methoxy-)

using model chemistry: HF/STO-3G

States and conformations

All results from a given calculation for CH₂C(CH₃)OCH₃ (1-Propene, 2-methoxy-)