Geometry & MOs

Info

ID:	153200
PubChem CID:	56312356
Reduced:	SO2N3C19H21 (1)
Stoich.:	AB2C3D19E21 (1)
Weight, g/mol:	408.11775
ΔH_f, kcal/mol:	4.53
Dipole, Da:	6.36
IP(EA), eV:	-9.34(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-cyclopropyl-1-N-(3-phenylbutyl)benzene-1,4-disulfonamide

Drug info:

PubChemData

Smile

CC(CCNS(=O)(=O)C1=CN(N=C1)C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations