Geometry & MOs

Info

ID:	195733
PubChem CID:	78729007
Reduced:	SN2O4C17H24 (1)
Stoich.:	AB2C4D17E24 (1)
Weight, g/mol:	356.037541
ΔH_f, kcal/mol:	-168.71
Dipole, Da:	2.09
IP(EA), eV:	-8.53(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chloro-4-fluorophenoxy)-N-(4-fluoro-3-nitrophenyl)propanamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1C)C(=O)COC(=O)C(CCSC)NC(=O)N)C

DOS

IR

Vibrations