Geometry & MOs

Info

ID:	325438
PubChem CID:	126683276
Reduced:	NH19C27 (1)
Stoich.:	AB19C27 (1)
Weight, g/mol:	712.287849
ΔH_f, kcal/mol:	116.34
Dipole, Da:	1.64
IP(EA), eV:	-8.03(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-(15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1,3,5(14),6,8(13),9,11-heptaen-15-yl)naphthalen-1-yl]-N,N-bis(4-phenylphenyl)aniline

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=CC(=CC=C2)N3C4=CC=CC5=C4C6=C(C=CC=C63)C=C5

DOS

IR

Vibrations