Geometry & MOs

Info

ID:	50637
PubChem CID:	12013198
Reduced:	GeO2C12H20 (1)
Stoich.:	AB2C12D20 (1)
Weight, g/mol:	392.06685
ΔH_f, kcal/mol:	-99.05
Dipole, Da:	5.23
IP(EA), eV:	-9.65(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,7aS)-4-[tert-butyl(dimethyl)silyl]oxy-3-iodo-1,4,5,6,7,7a-hexahydroinden-2-one

Drug info:

PubChemData

Smile

C[Ge](C)(C)C1=C2[C@@H](CCC[C@H]2O)CC1=O

DOS

IR

Vibrations