Geometry & MOs

Info

ID:	60272
PubChem CID:	26676074
Reduced:	FN2O3H11C15 (1)
Stoich.:	AB2C3D11E15 (1)
Weight, g/mol:	487.06942
ΔH_f, kcal/mol:	-30.2
Dipole, Da:	2.73
IP(EA), eV:	-9.04(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-cyanophenyl)methyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)thiophene-2-sulfonamide

Drug info:

PubChemData

Smile

C1=CC=[N+](C(=C1)OCC2=NC=C(O2)C3=CC=C(C=C3)F)[O-]

DOS

IR

Vibrations