Geometry & MOs

Info

ID:	61021
PubChem CID:	26704390
Reduced:	FNSO5C21H24 (1)
Stoich.:	ABCD5E21F24 (1)
Weight, g/mol:	313.086956
ΔH_f, kcal/mol:	-212.93
Dipole, Da:	3.22
IP(EA), eV:	-8.63(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-5-chloro-N-(2,3-dihydro-1H-inden-5-yl)-2,3-dihydro-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

CCCOC1=CC=C(C=C1)OC(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations