Geometry & MOs

Info

ID:	143953
PubChem CID:	53286936
Reduced:	FSN2O4C19H23 (1)
Stoich.:	ABC2D4E19F23 (1)
Weight, g/mol:	491.047333
ΔH_f, kcal/mol:	-182.61
Dipole, Da:	4.32
IP(EA), eV:	-8.71(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[4-[(3,5-dichloro-N-methylsulfonylanilino)methyl]benzoyl]amino]benzamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)N(CCCC(=O)NC2=CC=C(C=C2)F)S(=O)(=O)C

DOS

IR

Vibrations