Geometry & MOs

Info

ID:	441834
PubChem CID:	135245628
Reduced:	OCl2N2C15H16 (1)
Stoich.:	AB2C2D15E16 (1)
Weight, g/mol:	499.204848
ΔH_f, kcal/mol:	13.16
Dipole, Da:	1.84
IP(EA), eV:	-8.75(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(benzenecarboximidoyl)-3-triphenylen-2-ylnaphthalene-2-carboximidamide

Drug info:

PubChemData

Smile

C[C@H]1CC[C@H]1COC2=NN(C=C2)C3=CC(=C(C=C3)Cl)Cl

DOS

IR

Vibrations