Geometry & MOs

Info

ID:	322093
PubChem CID:	126668565
Reduced:	SN3O3C18H27 (1)
Stoich.:	AB3C3D18E27 (1)
Weight, g/mol:	343.062677
ΔH_f, kcal/mol:	-136.29
Dipole, Da:	7.4
IP(EA), eV:	-9.46(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

Drug info:

PubChemData

Smile

CCCCCOC1CCC(CC1)NC(=O)C2=CN=C3N(C2=O)CCS3

DOS

IR

Vibrations