Geometry & MOs

Info

ID:	293751
PubChem CID:	117399950
Reduced:	N2C17H26 (1)
Stoich.:	A2B17C26 (1)
Weight, g/mol:	258.065887
ΔH_f, kcal/mol:	-0.97
Dipole, Da:	2.86
IP(EA), eV:	-8.68(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[5-chloro-2-(methoxymethyl)phenyl]-2-hydroxyacetate

Drug info:

PubChemData

Smile

C1CCN(CC1)CC2=CC=CC=C2CC3CCCN3

DOS

IR

Vibrations