WebMO Job Summary

Quantity	Value
Route	#N M062X/6-311+G(2d,p) NMR Geom=Connectivity
Stoichiometry	C14H14O
Symmetry	C1
Basis	6-311+G(2d,p)
RM062X Energy	-617.055204909 Hartree
Dipole Moment	1.1966 Debye
Server	batch (252302)
CPU time	5312.3 sec

Constant	Frequency (GHz)	Frequency (cm-1)
a	2.5928969	0.08648973084
b	0.2384863	0.00795504669
c	0.2229888	0.00743810573

Atom	Symbol	Charge
1	C	-0.673639
2	C	0.717938
3	C	-0.390063
4	C	-0.545261
5	C	0.859689
6	C	-0.485200
7	C	-0.470066
8	H	0.123879
9	H	0.130046
10	C	0.843095
11	C	-0.278460
12	C	-0.358162
13	C	-0.008387
14	C	0.062327
15	C	-0.710529
16	H	0.131001
17	H	0.124298
18	O	-0.292389
19	C	-0.277006
20	H	0.165070
21	H	0.161003
22	H	0.160352
23	H	0.129648
24	H	0.133201
25	H	0.132371
26	H	0.124645
27	H	0.155463
28	H	0.178701
29	H	0.156434

Atom	Symbol	Isotropic	Anisotropy
1	C*	24.4259	42.7080
2	C*	155.9278	232.1753
3	C*	149.9736	189.7560
4	C*	147.7938	193.0967
5	C*	161.3605	218.2731
6	C*	147.6578	192.5393
7	C*	149.6622	188.3567
8	H*	8.2435	8.4982
9	H*	8.3499	9.9272
10	C*	156.3064	207.6852
11	C*	149.3121	195.1893
12	C*	136.6266	172.5127
13	C*	179.3796	161.3901
14	C*	125.7737	179.1776
15	C*	148.2767	194.6022
16	H*	8.4208	10.0224
17	H*	7.5388	8.9930
18	O	228.4677	85.0237
19	C*	55.2884	70.2484
20	H*	4.0886	8.3264
21	H*	3.6205	8.1675
22	H*	3.5989	7.8238
23	H*	7.9037	7.3368
24	H*	8.3714	9.5059
25	H*	8.3644	9.9229
26	H*	8.2820	8.5607
27	H*	1.8124	6.8534
28	H*	3.2632	8.5338
29	H*	1.9710	7.1095
*Denotes shift relative to TMS
TMS shielding (C)
TMS shielding (H)
1H NMR Spectrum
13C NMR Spectrum
Peak Width (ppm)

MOST BUREAUCRACIES FUNCTION LIKE A SEPTIC TANK. THE LARGE CHUNKS RISE TO THE TOP.