Geometry & MOs

Info

ID:	137942
PubChem CID:	52289040
Reduced:	SN4O4C19H22 (1)
Stoich.:	AB4C4D19E22 (1)
Weight, g/mol:	355.158372
ΔH_f, kcal/mol:	-106.42
Dipole, Da:	11.86
IP(EA), eV:	-9.22(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-2-(4-fluorophenoxy)-N,2-dimethylpropanamide

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=C(C=C1)NC(=O)C2CC2)NC(=O)NC3=CN=C(C=C3)S(=O)(=O)C

DOS

IR

Vibrations