Geometry & MOs

Info

ID:	381015
PubChem CID:	134971640
Reduced:	O4C19H22 (1)
Stoich.:	A4B19C22 (1)
Weight, g/mol:	428.238286
ΔH_f, kcal/mol:	-147.16
Dipole, Da:	0.94
IP(EA), eV:	-9.58(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(R)-[(4S,5R)-5-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-2,2-dimethyl-1,3-dioxolan-4-yl]-phenylmethanol

Drug info:

PubChemData

Smile

CC1(O[C@H]([C@@H](O1)[C@@H](C2=CC=CC=C2)O)[C@H](C3=CC=CC=C3)O)C

DOS

IR

Vibrations