Geometry & MOs

Info

ID:	144311
PubChem CID:	53348535
Reduced:	OC7H14 (3)
Stoich.:	AB7C14 (3)
Weight, g/mol:	474.295407
ΔH_f, kcal/mol:	-229.41
Dipole, Da:	3.64
IP(EA), eV:	-9.8(1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,3aS,4R,5R,7aS)-7a-but-3-enyl-3-[tert-butyl(diphenyl)silyl]oxy-5-methyl-1,2,3,3a,4,5,6,7-octahydroindene-4-carbaldehyde

Drug info:

PubChemData

Smile

CCCCCCCCCCCCC[C@H]1C[C@H](OC(O1)(C)C)[C@@H](C)O

DOS

IR

Vibrations