Geometry & MOs

Info

ID:	137525
PubChem CID:	52219568
Reduced:	NSCl3O4H14C17 (1)
Stoich.:	ABC3D4E14F17 (1)
Weight, g/mol:	379.099063
ΔH_f, kcal/mol:	-141.85
Dipole, Da:	3.35
IP(EA), eV:	-9.41(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-[3-[(4-methyl-1,3-thiazol-2-yl)carbamoyl]phenyl]-2,3-dihydro-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)C1=CC=C(S1)CNC(=O)C)OC(=O)C2=C(C=CC(=C2Cl)Cl)Cl

DOS

IR

Vibrations