Geometry & MOs

Info

ID:	432824
PubChem CID:	135172961
Reduced:	NO3H15C16 (1)
Stoich.:	AB3C15D16 (1)
Weight, g/mol:	1018.381081
ΔH_f, kcal/mol:	-73.7
Dipole, Da:	3.24
IP(EA), eV:	-8.42(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[4-[1-(4-hydroxyphenyl)-3,4-diphenyltriphenylen-2-yl]phenyl]-3,4-diphenyltriphenylen-1-yl]phenol

Drug info:

PubChemData

Smile

CCOC(=O)CNC1=CC2=C(C=C1)C3=CC=CC=C3O2

DOS

IR

Vibrations