Geometry & MOs

Info

ID:	436872
PubChem CID:	135212441
Reduced:	ON5H27C47 (1)
Stoich.:	AB5C27D47 (1)
Weight, g/mol:	410.178299
ΔH_f, kcal/mol:	252.05
Dipole, Da:	7.19
IP(EA), eV:	-8.14(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

12-(9,9-dimethylfluoren-4-yl)imidazo[1,2-f]phenanthridine

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=CC=CC=C3N4C2=NC5=C4N(C6=CC=CC=C65)C7=NC8=CC=CC=C8C(=N7)C9=CC=C(C=C9)C1=CC=CC2=C1OC1=CC=CC=C21

DOS

IR

Vibrations