Geometry & MOs

Info

ID:	376625
PubChem CID:	134222646
Reduced:	N2H15C23 (2)
Stoich.:	A2B15C23 (2)
Weight, g/mol:	573.197
ΔH_f, kcal/mol:	242.02
Dipole, Da:	1.63
IP(EA), eV:	-9.05(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4-(4-diphenylphosphorylphenyl)cyclohexa-2,4-dien-1-yl]benzimidazolo[1,2-c]quinazoline

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=NC3=CC=CC=C32)C4=CC=CC(=N4)C5=CC(=CC=C5)C6=NC(=CC=C6)C7=NC8=CC=CC=C8C(=C7)C9=CC=CC=C9

DOS

IR

Vibrations