Geometry & MOs

Info

ID:	274450
PubChem CID:	103809427
Reduced:	OSN3C14H17 (1)
Stoich.:	ABC3D14E17 (1)
Weight, g/mol:	304.135782
ΔH_f, kcal/mol:	-11.96
Dipole, Da:	4.58
IP(EA), eV:	-8.95(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzothiazol-6-yl)-2-methyl-2-piperazin-1-ylpropanamide

Drug info:

PubChemData

Smile

C1CCC(C(C1)C(=O)NC2=CC3=C(C=C2)N=CS3)N

DOS

IR

Vibrations