Geometry & MOs

Info

ID:	12355
PubChem CID:	135764
Reduced:	O3C24H26 (1)
Stoich.:	A3B24C26 (1)
Weight, g/mol:	362.188195
ΔH_f, kcal/mol:	-95.05
Dipole, Da:	5.49
IP(EA), eV:	-8.64(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 9-anthracen-2-yl-9-oxononanoate

Drug info:

PubChemData

Smile

COC(=O)CCCCCCCC(=O)C1=CC2=CC3=CC=CC=C3C=C2C=C1

DOS

IR

Vibrations