Geometry & MOs

Info

ID:	61345
PubChem CID:	26708359
Reduced:	SN3O5C23H31 (1)
Stoich.:	AB3C5D23E31 (1)
Weight, g/mol:	409.055484
ΔH_f, kcal/mol:	-203.57
Dipole, Da:	7.02
IP(EA), eV:	-9.37(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6,7-dihydro-[1,4]dioxino[2,3-f][1,3]benzothiazol-2-yl)-2-methyl-4-phenyl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC(C)N(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CNC(=O)OC(C)(C)C

DOS

IR

Vibrations