Geometry & MOs

Info

ID:	60210
PubChem CID:	26675909
Reduced:	SN2O5C19H22 (1)
Stoich.:	AB2C5D19E22 (1)
Weight, g/mol:	456.115521
ΔH_f, kcal/mol:	-173.88
Dipole, Da:	5.26
IP(EA), eV:	-9.13(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[[2-(3-fluoroanilino)-2-oxoethyl]-(4-methylphenyl)sulfonylamino]benzoate

Drug info:

PubChemData

Smile

CCNC(=O)CN(C1=CC=C(C=C1)C(=O)OC)S(=O)(=O)C2=CC=C(C=C2)C

DOS

IR

Vibrations