Geometry & MOs

Info

ID:	311650
PubChem CID:	126596832
Reduced:	ON2H20C30 (1)
Stoich.:	AB2C20D30 (1)
Weight, g/mol:	452.188863
ΔH_f, kcal/mol:	102.3
Dipole, Da:	3.95
IP(EA), eV:	-8.18(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-methylcarbazol-9-yl)-2-(1,2,8,9-tetrahydrodibenzofuran-2-yl)benzonitrile

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=C(C=CC(=C4)N)C5=CC6=C(C=C5)OC7=CC=CC=C76

DOS

IR

Vibrations