Geometry & MOs

Info

ID:	223775
PubChem CID:	85335555
Reduced:	FSN6O6C24H29 (1)
Stoich.:	ABC6D6E24F29 (1)
Weight, g/mol:	548.222405
ΔH_f, kcal/mol:	-148.71
Dipole, Da:	2.06
IP(EA), eV:	-9.43(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-[(6-chloronaphthalen-2-yl)sulfonylamino]-2-oxopyrrolidin-1-yl]-N-(2-piperidin-1-ylethyl)-N-propan-2-ylpropanamide

Drug info:

PubChemData

Smile

C1COCCN1C(=NCCCCC(C(=O)NO)NS(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)F)NC#N

DOS

IR

Vibrations