Geometry & MOs

Info

ID:	8150
PubChem CID:	75166
Reduced:	O4H18C25 (1)
Stoich.:	A4B18C25 (1)
Weight, g/mol:	382.120509
ΔH_f, kcal/mol:	-67.73
Dipole, Da:	2.32
IP(EA), eV:	-8.55(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-benzoyloxy-3-methylnaphthalen-1-yl) benzoate

Drug info:

PubChemData

Smile

CC1=C(C2=CC=CC=C2C(=C1)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

DOS

IR

Vibrations