Geometry & MOs

Info

ID:	293725
PubChem CID:	117397670
Reduced:	ClNO3C12H16 (1)
Stoich.:	ABC3D12E16 (1)
Weight, g/mol:	257.081871
ΔH_f, kcal/mol:	-105.45
Dipole, Da:	6.2
IP(EA), eV:	-8.9(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chloro-2-ethoxy-4-methoxyphenyl)-2-(methylamino)ethanone

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1OC)Cl)C(=O)CNC)OC

DOS

IR

Vibrations