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	hartrees
Energy at 0K	-230.970134
Energy at 298.15K	-230.978904
Nuclear repulsion energy	180.875186

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3419	3105	10.22
2	A	3323	3017	1.40
3	A	3296	2993	31.33
4	A	3290	2987	27.93
5	A	3246	2948	15.36
6	A	3241	2943	72.86
7	A	3184	2891	34.24
8	A	3171	2879	46.14
9	A	1879	1706	134.52
10	A	1610	1462	5.35
11	A	1605	1457	9.77
12	A	1593	1447	5.32
13	A	1585	1439	4.27
14	A	1576	1431	7.76
15	A	1539	1397	15.74
16	A	1511	1372	45.09
17	A	1415	1285	180.88
18	A	1305	1185	1.17
19	A	1266	1149	8.26
20	A	1232	1118	142.33
21	A	1153	1047	3.27
22	A	1102	1000	3.44
23	A	1013	920	12.91
24	A	991	900	50.60
25	A	879	798	11.53
26	A	819	744	3.35
27	A	596	541	5.52
28	A	510	463	8.01
29	A	446	405	1.09
30	A	320	290	1.69
31	A	242	220	1.98
32	A	183	166	1.27
33	A	69	63	7.09

Atom	x (Å)	y (Å)	z (Å)
C1	1.806	-0.037	0.249
H2	1.692	-0.193	1.325
H3	2.670	-0.599	-0.099
H4	1.981	1.024	0.057
O5	0.699	-0.528	-0.457
C6	-0.752	1.383	-0.023
H7	-0.184	1.849	0.786
H8	-0.427	1.840	-0.961
H9	-1.805	1.610	0.132
C10	-0.537	-0.103	-0.073
C11	-1.479	-1.001	0.166
H12	-2.489	-0.697	0.401
H13	-1.257	-2.057	0.103

	C1	H2	H3	H4	O5	C6	H7	H8	H9	C10	C11	H12	H13
C1		1.0936	1.0875	1.0925	1.4022	2.9393	2.7944	3.1585	3.9715	2.3667	3.4245	4.3479	3.6722
H2	1.0936		1.7748	1.7817	2.0679	3.2060	2.8252	3.7216	4.1119	2.6331	3.4713	4.3110	3.6964
H3	1.0875	1.7748		1.7699	2.0049	3.9559	3.8630	4.0353	4.9964	3.2458	4.1766	5.1838	4.1939
H4	1.0925	1.7817	1.7699		2.0775	2.7579	2.4292	2.7384	3.8322	2.7620	4.0101	4.8016	4.4698
O5	1.4022	2.0679	2.0049	2.0775		2.4390	2.8240	2.6702	3.3453	1.3626	2.3137	3.3051	2.5451
C6	2.9393	3.2060	3.9559	2.7579	2.4390		1.0923	1.0927	1.0883	1.5029	2.4999	2.7427	3.4800
H7	2.7944	2.8252	3.8630	2.4292	2.8240	1.0923		1.7633	1.7640	2.1614	3.1908	3.4551	4.1078
H8	3.1585	3.7216	4.0353	2.7384	2.6702	1.0927	1.7633		1.7741	2.1395	3.2324	3.5414	4.1247
H9	3.9715	4.1119	4.9964	3.8322	3.3453	1.0883	1.7640	1.7741		2.1413	2.6319	2.4212	3.7085
C10	2.3667	2.6331	3.2458	2.7620	1.3626	1.5029	2.1614	2.1395	2.1413		1.3226	2.0937	2.0899
C11	3.4245	3.4713	4.1766	4.0101	2.3137	2.4999	3.1908	3.2324	2.6319	1.3226		1.0806	1.0811
H12	4.3479	4.3110	5.1838	4.8016	3.3051	2.7427	3.4551	3.5414	2.4212	2.0937	1.0806		1.8592
H13	3.6722	3.6964	4.1939	4.4698	2.5451	3.4800	4.1078	4.1247	3.7085	2.0899	1.0811	1.8592

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O5	C10	117.732	H2	C1	H3	108.925
H2	C1	H4	109.178	H2	C1	O5	111.296
H3	C1	H4	108.567	H3	C1	O5	106.589
H4	C1	O5	112.176	O5	C10	C6	116.589
O5	C10	C11	119.001	C6	C10	C11	124.323
H7	C6	H8	107.612	H7	C6	H9	107.989
H7	C6	C10	111.813	H8	C6	H9	108.865
H8	C6	C10	110.025	H9	C6	C10	110.438
C10	C11	H12	120.879	C10	C11	H13	120.458
H12	C11	H13	118.644

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

using model chemistry: HF/cc-pVDZ

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	CHELPG
1	C	0.172	0.235
2	H	0.021	-0.010
3	H	0.047	0.023
4	H	0.023	-0.002
5	O	-0.447	-0.436
6	C	0.012	-0.259
7	H	0.044	0.074
8	H	0.051	0.090
9	H	0.044	0.073
10	C	-0.000	0.436
11	C	-0.038	-0.617
12	H	0.033	0.192
13	H	0.040	0.202

	x	y	z	Total
	0.607	1.398	0.957	1.800
CHELPG
AIM
ESP

	x	y	z
x	8.288	1.162	-0.353
y	1.162	7.481	-0.258
z	-0.353	-0.258	4.824

<r²>	127.464
(<r²>)^1/2	11.290

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

using model chemistry: HF/cc-pVDZ

States and conformations

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