Geometry & MOs

Info

ID:	238154
PubChem CID:	92729739
Reduced:	SN3O4C21H25 (1)
Stoich.:	AB3C4D21E25 (1)
Weight, g/mol:	443.187878
ΔH_f, kcal/mol:	-134.28
Dipole, Da:	6.32
IP(EA), eV:	-8.96(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-methyl-1-[3-[(4-propan-2-ylphenyl)sulfonylamino]benzoyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)N3CCC[C@@H](C3)C(=O)NC

DOS

IR

Vibrations