Geometry & MOs

Info

ID:	246922
PubChem CID:	103065610
Reduced:	OS2N4C12H18 (1)
Stoich.:	AB2C4D12E18 (1)
Weight, g/mol:	327.118753
ΔH_f, kcal/mol:	-24.65
Dipole, Da:	6.46
IP(EA), eV:	-8.48(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-2-(4-methylpiperazin-1-yl)-N-(thiolan-3-yl)-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

C1CC(C1)NC2=NC(=C(S2)C(=O)NC3CCSC3)N

DOS

IR

Vibrations