Geometry & MOs

Info

ID:	122931
PubChem CID:	50826816
Reduced:	FO3N5H24C26 (1)
Stoich.:	AB3C5D24E26 (1)
Weight, g/mol:	463.133255
ΔH_f, kcal/mol:	-33.39
Dipole, Da:	2.98
IP(EA), eV:	-8.8(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[(4-chlorophenyl)sulfonylamino]benzoyl]-N-propan-2-ylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CN(CCC1=NOC(=N1)C2=CC=C(C=C2)C(=O)NCC3=CC=C(C=C3)F)C(=O)NC4=CC=CC=C4

DOS

IR

Vibrations