Geometry & MOs

Info

ID:	153199
PubChem CID:	56312355
Reduced:	ClSN2O4C21H25 (1)
Stoich.:	ABC2D4E21F25 (1)
Weight, g/mol:	355.135448
ΔH_f, kcal/mol:	-127.21
Dipole, Da:	6.35
IP(EA), eV:	-8.51(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-phenyl-N-(3-phenylbutyl)pyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

CC1CN(CCN1CCS(=O)(=O)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)C(=O)OC

DOS

IR

Vibrations