Geometry & MOs

Info

ID:	157024
PubChem CID:	56412907
Reduced:	SN4O4C25H36 (1)
Stoich.:	AB4C4D25E36 (1)
Weight, g/mol:	457.180205
ΔH_f, kcal/mol:	-131.79
Dipole, Da:	7.42
IP(EA), eV:	-8.99(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[(2S)-1-[4-[(2,6-dimethylmorpholin-4-yl)methyl]piperidin-1-yl]-1-oxopropan-2-yl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)CC2CCN(CC2)C(=O)C3CCCN(C3)C4=NS(=O)(=O)C5=CC=CC=C54

DOS

IR

Vibrations