Geometry & MOs

Info

ID:	347324
PubChem CID:	127272173
Reduced:	SO2N4C19H20 (1)
Stoich.:	AB2C4D19E20 (1)
Weight, g/mol:	388.156912
ΔH_f, kcal/mol:	-12.17
Dipole, Da:	4.97
IP(EA), eV:	-8.5(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(cyclopropanecarbonylamino)-N-(5-methoxy-2-methyl-1,3-benzothiazol-6-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NC2=CC(=C(C=C2S1)NC(=O)N3CCCC3C4=CC=NC=C4)OC

DOS

IR

Vibrations