Geometry & MOs

Info

ID:	436334
PubChem CID:	135199101
Reduced:	FNO4C23H36 (1)
Stoich.:	ABC4D23E36 (1)
Weight, g/mol:	723.267448
ΔH_f, kcal/mol:	-273.97
Dipole, Da:	1.47
IP(EA), eV:	-9.34(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4-[7-(9H-pyrido[3,2-i][1]benzazepin-6-yl)triphenylen-2-yl]phenyl]benzo[k]phenanthridine

Drug info:

PubChemData

Smile

CCC(CC)[C@@H](C1=C(C=C(C=C1)F)C)[C@H](C)OC(=O)[C@H](C)NC(=O)OC(C)(C)C

DOS

IR

Vibrations