Geometry & MOs

Info

ID:	35466
PubChem CID:	7979911
Reduced:	ClSN2O3C20H23 (1)
Stoich.:	ABC2D3E20F23 (1)
Weight, g/mol:	372.00799
ΔH_f, kcal/mol:	-104.89
Dipole, Da:	7.52
IP(EA), eV:	-9.17(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(2-chloro-4-fluorophenyl)-2-(4-chloro-2-nitrophenoxy)propanamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CC3=CC=CC=C3Cl

DOS

IR

Vibrations