Geometry & MOs

Info

ID:	144965
PubChem CID:	53440930
Reduced:	NSO3C11H13 (1)
Stoich.:	ABC3D11E13 (1)
Weight, g/mol:	242.070972
ΔH_f, kcal/mol:	-105.95
Dipole, Da:	3.6
IP(EA), eV:	-9.53(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[2-(2-chloroethoxy)ethoxy]phenyl]ethanone

Drug info:

PubChemData

Smile

CC(C(=O)OC)(NC(=O)C1=CC=CC=C1)S

DOS

IR

Vibrations