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	hartrees
Energy at 0K	-307.115699
Energy at 298.15K	-307.127535
HF Energy	-307.115699
Nuclear repulsion energy	268.783875

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3257	2952	52.66
2	A'	3251	2946	20.85
3	A'	3183	2885	122.24
4	A'	3173	2876	16.96
5	A'	3139	2845	85.79
6	A'	3091	2801	35.52
7	A'	1632	1479	3.76
8	A'	1627	1474	3.08
9	A'	1614	1463	12.85
10	A'	1599	1450	3.20
11	A'	1547	1402	58.48
12	A'	1503	1362	11.23
13	A'	1387	1257	36.09
14	A'	1293	1172	51.54
15	A'	1281	1161	11.10
16	A'	1224	1110	3.32
17	A'	1166	1057	54.84
18	A'	910	825	7.25
19	A'	576	522	7.60
20	A'	481	436	13.43
21	A'	276	250	3.28
22	A'	179	162	1.91
23	A'	56	50	4.38
24	A"	3257	2952	36.15
25	A"	3233	2931	58.75
26	A"	3179	2882	14.15
27	A"	3135	2842	53.43
28	A"	1634	1481	1.01
29	A"	1623	1471	6.53
30	A"	1617	1466	6.99
31	A"	1601	1451	1.20
32	A"	1543	1399	64.71
33	A"	1343	1217	227.90
34	A"	1285	1165	2.84
35	A"	1271	1152	268.99
36	A"	1187	1076	54.93
37	A"	1006	912	5.78
38	A"	497	450	1.17
39	A"	377	342	1.17
40	A"	251	228	0.02
41	A"	204	185	0.16
42	A"	34	31	0.30

Atom	x (Å)	y (Å)	z (Å)
O1	-0.475	-0.467	1.104
O2	-0.475	-0.467	-1.104
C3	-0.475	0.275	2.287
C4	-0.475	0.275	-2.287
C5	0.113	0.138	0.000
C6	1.619	-0.052	0.000
H7	0.528	0.441	2.661
H8	0.528	0.441	-2.661
H9	-1.028	-0.289	3.021
H10	-1.028	-0.289	-3.021
H11	-0.959	1.235	2.142
H12	-0.959	1.235	-2.142
H13	-0.148	1.195	0.000
H14	1.841	-1.110	0.000
H15	2.069	0.402	-0.873
H16	2.069	0.402	0.873

	O1	O2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12	H13	H14	H15	H16
O1		2.2073	1.3966	3.4706	1.3894	2.4038	2.0633	4.0003	2.0036	4.1655	2.0521	3.6966	2.0218	2.6451	3.3369	2.6984
O2	2.2073		3.4706	1.3966	1.3894	2.4038	4.0003	2.0633	4.1655	2.0036	3.6966	2.0521	2.0218	2.6451	2.6984	3.3369
C3	1.3966	3.4706		4.5732	2.3651	3.1180	1.0838	5.0507	1.0788	5.3662	1.0853	4.5569	2.4863	3.5372	4.0584	2.9131
C4	3.4706	1.3966	4.5732		2.3651	3.1180	5.0507	1.0838	5.3662	1.0788	4.5569	1.0853	2.4863	3.5372	2.9131	4.0584
C5	1.3894	1.3894	2.3651	2.3651		1.5179	2.7099	2.7099	3.2577	3.2577	2.6347	2.6347	1.0887	2.1313	2.1578	2.1578
C6	2.4038	2.4038	3.1180	3.1180	1.5179		2.9176	2.9176	4.0241	4.0241	3.5906	3.5906	2.1622	1.0814	1.0817	1.0817
H7	2.0633	4.0003	1.0838	5.0507	2.7099	2.9176		5.3213	1.7568	5.9363	1.7644	5.0897	2.8466	3.3480	3.8550	2.3602
H8	4.0003	2.0633	5.0507	1.0838	2.7099	2.9176	5.3213		5.9363	1.7568	5.0897	1.7644	2.8466	3.3480	2.3602	3.8550
H9	2.0036	4.1655	1.0788	5.3662	3.2577	4.0241	1.7568	5.9363		6.0423	1.7615	5.3835	3.4792	4.2467	5.0233	3.8320
H10	4.1655	2.0036	5.3662	1.0788	3.2577	4.0241	5.9363	1.7568	6.0423		5.3835	1.7615	3.4792	4.2467	3.8320	5.0233
H11	2.0521	3.6966	1.0853	4.5569	2.6347	3.5906	1.7644	5.0897	1.7615	5.3835		4.2831	2.2906	4.2344	4.3533	3.3872
H12	3.6966	2.0521	4.5569	1.0853	2.6347	3.5906	5.0897	1.7644	5.3835	1.7615	4.2831		2.2906	4.2344	3.3872	4.3533
H13	2.0218	2.0218	2.4863	2.4863	1.0887	2.1622	2.8466	2.8466	3.4792	3.4792	2.2906	2.2906		3.0441	2.5104	2.5104
H14	2.6451	2.6451	3.5372	3.5372	2.1313	1.0814	3.3480	3.3480	4.2467	4.2467	4.2344	4.2344	3.0441		1.7608	1.7608
H15	3.3369	2.6984	4.0584	2.9131	2.1578	1.0817	3.8550	2.3602	5.0233	3.8320	4.3533	3.3872	2.5104	1.7608		1.7459
H16	2.6984	3.3369	2.9131	4.0584	2.1578	1.0817	2.3602	3.8550	3.8320	5.0233	3.3872	4.3533	2.5104	1.7608	1.7459

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C3	H7	111.961	O1	C3	H9	107.381
O1	C3	H11	110.928	O1	C5	O2	105.187
O1	C5	C6	111.466	O1	C5	H13	108.742
O2	C4	H8	111.961	O2	C4	H10	107.381
O2	C4	H12	110.928	O2	C5	C6	111.466
O2	C5	H13	108.742	C3	O1	C5	116.190
C4	O2	C5	116.190	C5	C6	H14	108.998
C5	C6	H15	111.098	C5	C6	H16	111.098
C6	C5	H13	111.023	H7	C3	H9	108.661
H7	C3	H11	108.866	H8	C4	H10	108.661
H8	C4	H12	108.866	H9	C3	H11	108.971
H10	C4	H12	108.971	H14	C6	H15	108.988
H14	C6	H16	108.988	H15	C6	H16	107.620

All results from a given calculation for C₄H₁₀O₂ (1,1-Dimethoxyethane)

using model chemistry: HF/Def2TZVPP

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	O	-0.386
2	O	-0.386
3	C	0.017
4	C	0.017
5	C	0.449
6	C	-0.191
7	H	0.046
8	H	0.046
9	H	0.078
10	H	0.078
11	H	0.047
12	H	0.047
13	H	-0.022
14	H	0.069
15	H	0.044
16	H	0.044

	x	y	z	Total
	1.109	2.301	0.000	2.555
CHELPG
AIM
ESP

	x	y	z
x	7.767	-0.190	0.000
y	-0.190	7.235	0.000
z	0.000	0.000	9.388

<r²>	197.295
(<r²>)^1/2	14.046

All results from a given calculation for C4H10O2 (1,1-Dimethoxyethane)

using model chemistry: HF/Def2TZVPP

States and conformations

All results from a given calculation for C₄H₁₀O₂ (1,1-Dimethoxyethane)