Geometry & MOs

Info

ID:	186170
PubChem CID:	77398407
Reduced:	N3O3C29H31 (1)
Stoich.:	A3B3C29D31 (1)
Weight, g/mol:	757.334465
ΔH_f, kcal/mol:	-46.44
Dipole, Da:	3.81
IP(EA), eV:	-8.84(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-dibenzofuran-2-ylphenyl)-5,5-dimethyl-10-methylidene-3-phenyl-N-[4-(4-phenylphenyl)phenyl]benzo[8]annulen-7-amine

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)C2=CN3C(=CC=N3)C=C2)N4CCC(OC4=O)(CC(C)(C)O)C5=CC=CC=C5

DOS

IR

Vibrations