Geometry & MOs

Info

ID:	263602
PubChem CID:	103381699
Reduced:	SN3O3C11H19 (1)
Stoich.:	AB3C3D11E19 (1)
Weight, g/mol:	295.146681
ΔH_f, kcal/mol:	-109.82
Dipole, Da:	2.98
IP(EA), eV:	-8.54(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-5-(3-piperidin-1-ylpyrrolidin-1-yl)-1,2-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(SN=C1N)N(C)CCCOC

DOS

IR

Vibrations