Geometry & MOs

Info

ID:	275630
PubChem CID:	103816807
Reduced:	NSO4C15H19 (1)
Stoich.:	ABC4D15E19 (1)
Weight, g/mol:	396.9975
ΔH_f, kcal/mol:	-167.63
Dipole, Da:	8.74
IP(EA), eV:	-9.64(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-iodobenzamide

Drug info:

PubChemData

Smile

C1CS(=O)(=O)CC1CC(=O)N[C@@H]2[C@@H](CC3=CC=CC=C23)O

DOS

IR

Vibrations