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	hartrees
Energy at 0K	-42.259402
Energy at 298.15K	-42.267928
Nuclear repulsion energy	100.752839

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3427	3078	25.48
2	A	3350	3008	7.37
3	A	3330	2990	72.64
4	A	3317	2979	42.25
5	A	3285	2950	75.90
6	A	3280	2946	56.22
7	A	3225	2896	50.38
8	A	3217	2889	62.34
9	A	1880	1689	107.47
10	A	1633	1466	7.64
11	A	1625	1459	9.20
12	A	1618	1453	2.65
13	A	1613	1448	2.16
14	A	1603	1439	7.12
15	A	1564	1405	15.99
16	A	1524	1369	29.69
17	A	1404	1261	187.92
18	A	1318	1183	2.03
19	A	1279	1149	3.40
20	A	1212	1089	131.92
21	A	1159	1041	5.03
22	A	1100	988	8.92
23	A	1011	908	20.26
24	A	997	895	69.14
25	A	888	797	15.13
26	A	811	728	3.84
27	A	597	536	4.28
28	A	486	436	11.11
29	A	414	372	1.86
30	A	286	257	4.38
31	A	214	192	0.26
32	A	194	174	0.91
33	A	21	19	4.35

Atom	x (Å)	y (Å)	z (Å)
C1	-1.785	-0.139	0.315
H2	-1.930	0.837	0.781
H3	-2.691	-0.431	-0.209
H4	-1.567	-0.874	1.094
O5	-0.750	-0.090	-0.649
C6	1.332	-1.090	0.094
H7	0.831	-1.763	0.794
H8	1.452	-1.626	-0.849
H9	2.315	-0.843	0.490
C10	0.502	0.158	-0.135
C11	0.924	1.415	0.088
H12	1.915	1.607	0.471
H13	0.285	2.262	-0.128

	C1	H2	H3	H4	O5	C6	H7	H8	H9	C10	C11	H12	H13
C1		1.0911	1.0873	1.0928	1.4148	3.2660	3.1154	3.7471	4.1636	2.3492	3.1312	4.0946	3.2004
H2	1.0911		1.7798	1.7768	2.0725	3.8502	3.7919	4.4897	4.5746	2.6857	2.9933	3.9339	2.7859
H3	1.0873	1.7798		1.7773	2.0192	4.0883	3.8968	4.3593	5.0720	3.2480	4.0705	5.0834	4.0143
H4	1.0928	1.7768	1.7773		2.0780	3.0739	2.5744	3.6675	3.9290	2.6178	3.5293	4.3210	3.8412
O5	1.4148	2.0725	2.0192	2.0780		2.4266	2.7164	2.6923	3.3557	1.3763	2.3692	3.3530	2.6218
C6	3.2660	3.8502	4.0883	3.0739	2.4266		1.0925	1.0915	1.0883	1.5160	2.5380	2.7853	3.5185
H7	3.1154	3.7919	3.8968	2.5744	2.7164	1.0925		1.7615	1.7730	2.1584	3.2566	3.5552	4.1647
H8	3.7471	4.4897	4.3593	3.6675	2.6923	1.0915	1.7615		1.7752	2.1435	3.2257	3.5233	4.1227
H9	4.1636	4.5746	5.0720	3.9290	3.3557	1.0883	1.7730	1.7752		2.1631	2.6821	2.4825	3.7605
C10	2.3492	2.6857	3.2480	2.6178	1.3763	1.5160	2.1584	2.1435	2.1631		1.3448	2.1134	2.1151
C11	3.1312	2.9933	4.0705	3.5293	2.3692	2.5380	3.2566	3.2257	2.6821	1.3448		1.0800	1.0828
H12	4.0946	3.9339	5.0834	4.3210	3.3530	2.7853	3.5552	3.5233	2.4825	2.1134	1.0800		1.8564
H13	3.2004	2.7859	4.0143	3.8412	2.6218	3.5185	4.1647	4.1227	3.7605	2.1151	1.0828	1.8564

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O5	C10	114.631	H2	C1	H3	109.579
H2	C1	H4	108.898	H2	C1	O5	110.935
H3	C1	H4	109.223	H3	C1	O5	106.884
H4	C1	O5	111.283	O5	C10	C6	113.977
O5	C10	C11	121.062	C6	C10	C11	124.927
H7	C6	H8	107.523	H7	C6	H9	108.784
H7	C6	C10	110.625	H8	C6	H9	109.057
H8	C6	C10	109.507	H9	C6	C10	111.255
C10	C11	H12	120.892	C10	C11	H13	120.834
H12	C11	H13	118.266

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

using model chemistry: HF/CEP-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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Number	Element	Mulliken
1	C	-0.200
2	H	0.133
3	H	0.168
4	H	0.118
5	O	-0.312
6	C	-0.353
7	H	0.106
8	H	0.126
9	H	0.139
10	C	0.245
11	C	-0.558
12	H	0.217
13	H	0.171

	x	y	z	Total
	-0.215	-0.420	1.546	1.617
CHELPG
AIM
ESP

	x	y	z
x	6.715	0.759	0.252
y	0.759	8.041	0.308
z	0.252	0.308	4.660

<r²>	107.844
(<r²>)^1/2	10.385

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

using model chemistry: HF/CEP-31G*

States and conformations

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