Geometry & MOs

Info

ID:	353743
PubChem CID:	127285320
Reduced:	FSO2N5C18H24 (1)
Stoich.:	ABC2D5E18F24 (1)
Weight, g/mol:	393.163474
ΔH_f, kcal/mol:	-69.66
Dipole, Da:	9.63
IP(EA), eV:	-9.16(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)methyl]piperidin-3-yl]-3-fluorobenzenesulfonamide

Drug info:

PubChemData

Smile

C1CCN2C(=NN=C2CN3CCCC(C3)NS(=O)(=O)C4=CC=CC(=C4)F)C1

DOS

IR

Vibrations