Geometry & MOs

Info

ID:	432798
PubChem CID:	135172935
Reduced:	ON9C27H29 (1)
Stoich.:	AB9C27D29 (1)
Weight, g/mol:	1002.37091
ΔH_f, kcal/mol:	144.97
Dipole, Da:	8.64
IP(EA), eV:	-7.96(-2.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-[3-[10-[3,5-bis[4-(4-hydroxyphenyl)phenyl]phenyl]anthracen-9-yl]-5-[4-(4-hydroxyphenyl)phenyl]phenyl]phenyl]phenol

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=CN=CC3=N/C(=C\4/C5=CC(=NC=C5NN4)C6=CC(=CN=C6)NC(C7CCC7)O)/N=C23

DOS

IR

Vibrations