Geometry & MOs

Info

ID:	131675
PubChem CID:	51241477
Reduced:	FSO2N3H12C16 (1)
Stoich.:	ABC2D3E12F16 (1)
Weight, g/mol:	322.088434
ΔH_f, kcal/mol:	-44.23
Dipole, Da:	4.26
IP(EA), eV:	-9.17(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chloro-4-methoxyphenyl)-2-(4-fluoroanilino)propanamide

Drug info:

PubChemData

Smile

C1=CC(=O)N(C=C1)CC(=O)NC2=NC(=CS2)C3=CC(=CC=C3)F

DOS

IR

Vibrations