Geometry & MOs

Info

ID:	144926
PubChem CID:	53433416
Reduced:	SO2N3C15H15 (1)
Stoich.:	AB2C3D15E15 (1)
Weight, g/mol:	334.08097
ΔH_f, kcal/mol:	-18.86
Dipole, Da:	4.75
IP(EA), eV:	-9.33(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(2-methylpropyl)-7-oxo-5,6-dihydro-4H-1,3-benzothiazol-2-yl]-N-thiophen-2-ylformamide

Drug info:

PubChemData

Smile

CC1(CC2=C(C(=O)C1)SC(=N2)N(C=O)C3=CN=CC=C3)C

DOS

IR

Vibrations