Geometry & MOs

Info

ID:	130203
PubChem CID:	51075238
Reduced:	SO2N4C16H20 (1)
Stoich.:	AB2C4D16E20 (1)
Weight, g/mol:	332.14193
ΔH_f, kcal/mol:	-25.72
Dipole, Da:	5.09
IP(EA), eV:	-8.33(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-(dimethylamino)pyridin-3-yl]-4-(1,3-thiazol-2-yl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

C1COCCN1C2=NC=C(C=C2)NC(=O)NCCC3=CC=CS3

DOS

IR

Vibrations