Geometry & MOs

Info

ID:	39110
PubChem CID:	8139710
Reduced:	SN3O3C22H29 (1)
Stoich.:	AB3C3D22E29 (1)
Weight, g/mol:	424.169488
ΔH_f, kcal/mol:	-87.66
Dipole, Da:	4.02
IP(EA), eV:	-9.21(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

dimethyl-[[2-[[[4-(phenylsulfamoyl)benzoyl]amino]methyl]phenyl]methyl]azanium

Drug info:

PubChemData

Smile

CN(C)CC1=CC=CC=C1CNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

DOS

IR

Vibrations