Geometry & MOs

Info

ID:	78789
PubChem CID:	49731943
Reduced:	SN2O3C17H20 (1)
Stoich.:	AB2C3D17E20 (1)
Weight, g/mol:	382.135114
ΔH_f, kcal/mol:	-69.8
Dipole, Da:	4.74
IP(EA), eV:	-8.71(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(5-methoxy-1,3-benzothiazol-2-yl)oxy]piperidin-1-yl]-(3-methylphenyl)methanone

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)SC(=N2)OC3CCN(CC3)C(=O)C4CC4

DOS

IR

Vibrations