Geometry & MOs

Info

ID:	441668
PubChem CID:	135239590
Reduced:	O3C13H13 (2)
Stoich.:	A3B13C13 (2)
Weight, g/mol:	494.266839
ΔH_f, kcal/mol:	-159.34
Dipole, Da:	0.39
IP(EA), eV:	-8.29(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,3-diethyl-10-pentoxycarbonyloxyanthracen-9-yl) pentyl carbonate

Drug info:

PubChemData

Smile

CCC1=C2C(=CC=C1)C(=C3C(=C2OC(=O)OCC=C)C=CC=C3CC)OC(=O)OCC=C

DOS

IR

Vibrations