Geometry & MOs

Info

ID:	222413
PubChem CID:	85300627
Reduced:	SiC22H28 (1)
Stoich.:	AB22C28 (1)
Weight, g/mol:	320.117922
ΔH_f, kcal/mol:	26.79
Dipole, Da:	0.97
IP(EA), eV:	-9.25(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-chloro-4a-ethenyl-5,6-dimethoxy-1,2,4,9,10,10a-hexahydrophenanthren-3-one

Drug info:

PubChemData

Smile

CCCC(C=C)C(=C[Si](C)(C)C1=CC=CC=C1)C2=CC=CC=C2

DOS

IR

Vibrations