Geometry & MOs

Info

ID:	138939
PubChem CID:	52446412
Reduced:	ClO3N4C19H25 (1)
Stoich.:	AB3C4D19E25 (1)
Weight, g/mol:	374.130028
ΔH_f, kcal/mol:	-118.36
Dipole, Da:	3.44
IP(EA), eV:	-8.7(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-2-(2-ethoxyethoxy)propanamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(NC(=O)N[C@@H]1C)CN2CCN(CC2)C3=CC(=CC=C3)Cl

DOS

IR

Vibrations