Geometry & MOs

Info

ID:	338886
PubChem CID:	127259897
Reduced:	O3H34C35 (1)
Stoich.:	A3B34C35 (1)
Weight, g/mol:	432.172545
ΔH_f, kcal/mol:	-40.39
Dipole, Da:	4.07
IP(EA), eV:	-8.3(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 3-[(10-methylanthracen-9-yl)methoxy]benzoate

Drug info:

PubChemData

Smile

CCCCCCC1=C2C=CC=CC2=C(C3=CC=CC=C31)COC4=CC=CC(=C4)C(=O)OCC5=CC=CC=C5

DOS

IR

Vibrations