Geometry & MOs

Info

ID:	25208
PubChem CID:	620964
Reduced:	SN2C15H18 (1)
Stoich.:	AB2C15D18 (1)
Weight, g/mol:	446.226454
ΔH_f, kcal/mol:	51.97
Dipole, Da:	3.85
IP(EA), eV:	-8.62(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10,13-dimethyl-2'-phenylspiro[1,2,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthrene-17,4'-1,3,2-dioxaborinane]-3,5',11-trione

Drug info:

PubChemData

Smile

CN1C2CC=CCC2CSC1=NC3=CC=CC=C3

DOS

IR

Vibrations