Geometry & MOs

Info

ID:	379555
PubChem CID:	134444554
Reduced:	IC10H11 (1)
Stoich.:	AB10C11 (1)
Weight, g/mol:	557.190852
ΔH_f, kcal/mol:	45.07
Dipole, Da:	2.42
IP(EA), eV:	-9.07(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1Z)-buta-1,3-dienyl]-1-methyl-9-phenanthren-2-yl-3-phenylphospholo[3,2-b]carbazole 3-oxide

Drug info:

PubChemData

Smile

CC(C1=CC2=C(CC2)C=C1)I

DOS

IR

Vibrations