Geometry & MOs

Info

ID:	379779
PubChem CID:	134464853
Reduced:	NH33C45 (1)
Stoich.:	AB33C45 (1)
Weight, g/mol:	643.233371
ΔH_f, kcal/mol:	165.87
Dipole, Da:	0.68
IP(EA), eV:	-8.05(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-dibenzothiophen-3-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)phenanthren-9-amine

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C3=C1C=C(C=C3)N(C4=CC=C(C5=CC=CC=C54)C6=CC=CC=C6)C7=CC8=CC=CC=C8C9=CC=CC=C97)C

DOS

IR

Vibrations