Geometry & MOs

Info

ID:	163627
PubChem CID:	58106408
Reduced:	N2H32C51 (1)
Stoich.:	A2B32C51 (1)
Weight, g/mol:	472.193949
ΔH_f, kcal/mol:	233.68
Dipole, Da:	4.42
IP(EA), eV:	-8.34(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-1-(4-perylen-3-ylphenyl)benzimidazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC3=C(C=C2)N(C(=N3)C4=CC=C(C=C4)C5=C6C=CC7=CC=CC8=C7C6=C(C=C8)C=C5)C9=CC=C(C=C9)C1=CC=CC2=CC=CC=C21

DOS

IR

Vibrations