Geometry & MOs

Info

ID:	6459
PubChem CID:	68665
Reduced:	ClO3H13C14 (1)
Stoich.:	AB3C13D14 (1)
Weight, g/mol:	264.055322
ΔH_f, kcal/mol:	-93.6
Dipole, Da:	3.55
IP(EA), eV:	-8.58(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(1-chloronaphthalen-2-yl)oxypropanoate

Drug info:

PubChemData

Smile

CC(C(=O)OC)OC1=C(C2=CC=CC=C2C=C1)Cl

DOS

IR

Vibrations