Geometry & MOs

Info

ID:	50630
PubChem CID:	12013190
Reduced:	GeO3C15H24 (1)
Stoich.:	AB3C15D24 (1)
Weight, g/mol:	406.0825
ΔH_f, kcal/mol:	-151.28
Dipole, Da:	4.35
IP(EA), eV:	-9.73(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,6aS)-4-[tert-butyl(dimethyl)silyl]oxy-3-iodo-5,5-dimethyl-1,4,6,6a-tetrahydropentalen-2-one

Drug info:

PubChemData

Smile

CC(=O)O[C@H]1C2=C(C(=O)C[C@@H]2CC1(C)C)[Ge](C)(C)C

DOS

IR

Vibrations