Geometry & MOs

Info

ID:	298197
PubChem CID:	117648021
Reduced:	N3H29C42 (1)
Stoich.:	A3B29C42 (1)
Weight, g/mol:	751.298748
ΔH_f, kcal/mol:	213.09
Dipole, Da:	0.29
IP(EA), eV:	-7.54(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10-(4-phenanthren-9-ylnaphthalen-1-yl)-N,N,5-triphenylindolo[3,2-b]indol-3-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C3=CC=CC=C3C4=C2C5=C(N4C6=CC=CC7=CC=CC=C76)C=CC(=C5)N(C8=CC=CC=C8)C9=CC=CC=C9

DOS

IR

Vibrations