Geometry & MOs

Info

ID:	46762
PubChem CID:	10527087
Reduced:	O3C30H32 (1)
Stoich.:	A3B30C32 (1)
Weight, g/mol:	440.274672
ΔH_f, kcal/mol:	-52.35
Dipole, Da:	4.68
IP(EA), eV:	-9.49(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3R,4S,5S,6R)-1-[tert-butyl(diphenyl)silyl]oxy-2,4,6-trimethyloct-7-ene-3,5-diol

Drug info:

PubChemData

Smile

C[C@@]1(CC(=O)O[C@@H]1COC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(C)(C)C=C

DOS

IR

Vibrations