Geometry & MOs

Info

ID:	238105
PubChem CID:	92729689
Reduced:	SN3O4C23H27 (1)
Stoich.:	AB3C4D23E27 (1)
Weight, g/mol:	469.203528
ΔH_f, kcal/mol:	-115.57
Dipole, Da:	3.74
IP(EA), eV:	-8.96(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-cyclopropyl-1-[3-[(4-propylphenyl)sulfonylamino]benzoyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1S(=O)(=O)NC2=CC=CC(=C2)C(=O)N3CCC[C@@H](C3)C(=O)NC4CC4

DOS

IR

Vibrations