Geometry & MOs

Info

ID:	162698
PubChem CID:	57551469
Reduced:	FON3C21H22 (1)
Stoich.:	ABC3D21E22 (1)
Weight, g/mol:	426.195486
ΔH_f, kcal/mol:	-35.76
Dipole, Da:	5.61
IP(EA), eV:	-8.25(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[4-[2-(7-fluoro-2,4-dimethyl-1H-indol-3-yl)ethylcarbamoyl]phenoxy]pentanoic acid

Drug info:

PubChemData

Smile

C1CCN(C1)C2=CC=C(C=C2)C(=O)NCCC3=CNC4=C3C=CC=C4F

DOS

IR

Vibrations