Geometry & MOs

Info

ID:	168702
PubChem CID:	75005537
Reduced:	O4C33H36 (1)
Stoich.:	A4B33C36 (1)
Weight, g/mol:	466.262028
ΔH_f, kcal/mol:	-138.29
Dipole, Da:	8.09
IP(EA), eV:	-8.73(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-amino-3-methyl-5-oxo-1-(5,5,8,8-tetramethyl-6,7-dihydroanthracen-2-yl)penta-1,3-dien-2-yl]benzamide

Drug info:

PubChemData

Smile

CC(=CC(=O)O)C(=CCCC1=CC2=CC3=C(C=C2C=C1)C(CCC3(C)C)(C)C)C4=CC(=CC=C4)C(=O)O

DOS

IR

Vibrations