Geometry & MOs

Info

ID:	348979
PubChem CID:	127274705
Reduced:	SN2O4C18H30 (1)
Stoich.:	AB2C4D18E30 (1)
Weight, g/mol:	377.188546
ΔH_f, kcal/mol:	-195.87
Dipole, Da:	3.69
IP(EA), eV:	-8.54(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-butanoyl-N-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CCOC(C1)CSCC(=O)N2CCCC(C2)C(=O)N3CCOCC3

DOS

IR

Vibrations