Geometry & MOs

Info

ID:	386454
PubChem CID:	134981804
Reduced:	SSiO6C33H48 (1)
Stoich.:	ABC6D33E48 (1)
Weight, g/mol:	482.231093
ΔH_f, kcal/mol:	-287.7
Dipole, Da:	6.93
IP(EA), eV:	-8.62(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

S-ethyl 2-[(2S,6S)-6-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-4-methylideneoxan-2-yl]ethanethioate

Drug info:

PubChemData

Smile

CC[C@@H]1C(=CC[C@@H](O1)C(C)(C([C@H](C)CO[Si](C)(C)C(C)(C)C)S(=O)(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)C

DOS

IR

Vibrations