Geometry & MOs

Info

ID:	396154
PubChem CID:	135027547
Reduced:	SiO4C24H40 (1)
Stoich.:	AB4C24D40 (1)
Weight, g/mol:	528.272958
ΔH_f, kcal/mol:	-223.35
Dipole, Da:	2.98
IP(EA), eV:	-8.63(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E,3R,7R)-8-[tert-butyl(dimethyl)silyl]oxy-3-[(4-methoxyphenyl)methoxy]-3,7-dimethyl-1-phenylsulfanyloct-5-en-2-one

Drug info:

PubChemData

Smile

C[C@@H](CO[Si](C)(C)C(C)(C)C)/C=C/C[C@](C)(C(=O)C)OCC1=CC=C(C=C1)OC

DOS

IR

Vibrations