Geometry & MOs

Info

ID:	360511
PubChem CID:	127301156
Reduced:	SO3N5C18H23 (1)
Stoich.:	AB3C5D18E23 (1)
Weight, g/mol:	352.156912
ΔH_f, kcal/mol:	-102.72
Dipole, Da:	5.14
IP(EA), eV:	-9.95(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-methyl-1,3-thiazol-2-yl)-3-[4-(oxolane-2-carbonyl)piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

C1CN(C(=O)NC1=O)CC(=O)NC2=NN=C(S2)C34CC5CC(C3)CC(C5)C4

DOS

IR

Vibrations