Geometry & MOs

Info

ID:	4375
PubChem CID:	11310
Reduced:	O4H14C15 (1)
Stoich.:	A4B14C15 (1)
Weight, g/mol:	258.089209
ΔH_f, kcal/mol:	-141.31
Dipole, Da:	2.65
IP(EA), eV:	-8.59(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-acetyloxy-3-methylnaphthalen-1-yl) acetate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations