Geometry & MOs

Info

ID:	347359
PubChem CID:	127272208
Reduced:	SN3O3C18H21 (1)
Stoich.:	AB3C3D18E21 (1)
Weight, g/mol:	372.128983
ΔH_f, kcal/mol:	-66.13
Dipole, Da:	4.87
IP(EA), eV:	-8.88(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-methylsulfonylpiperidin-4-yl)-4-(1,3-thiazol-2-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC2=C(C=C1)OCO2)NC(=O)N3CCC(CC3)C4=NC=CS4

DOS

IR

Vibrations