Geometry & MOs

Info

ID:	377518
PubChem CID:	134223575
Reduced:	O3H24C25 (1)
Stoich.:	A3B24C25 (1)
Weight, g/mol:	659.239519
ΔH_f, kcal/mol:	-52.84
Dipole, Da:	6.95
IP(EA), eV:	-9.35(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[8-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-2-yl]-9-[(2E,4Z)-hexa-2,4-dien-2-yl]carbazole

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)OC

DOS

IR

Vibrations