Geometry & MOs

Info

ID:	124666
PubChem CID:	50891472
Reduced:	FNSO5C16H16 (1)
Stoich.:	ABCD5E16F16 (1)
Weight, g/mol:	387.009884
ΔH_f, kcal/mol:	-194.21
Dipole, Da:	6.24
IP(EA), eV:	-8.9(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(N-(4-chlorophenyl)sulfonyl-3-methoxyanilino)propanoyl chloride

Drug info:

PubChemData

Smile

COC1=CC=CC=C1N(CC(=O)OC)S(=O)(=O)C2=CC=C(C=C2)F

DOS

IR

Vibrations