Geometry & MOs

Info

ID:	60944
PubChem CID:	26703409
Reduced:	ClSN2O4C22H27 (1)
Stoich.:	ABC2D4E22F27 (1)
Weight, g/mol:	333.076786
ΔH_f, kcal/mol:	-132.14
Dipole, Da:	7.83
IP(EA), eV:	-9.43(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-(5-chloro-2,4-dimethoxyphenyl)-2,3-dihydro-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

C[C@@H]1CN(C[C@H](O1)C)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N(C)[C@H](C)C3=CC=CC=C3)Cl

DOS

IR

Vibrations