Geometry & MOs

Info

ID:	187777
PubChem CID:	77622163
Reduced:	F2N3O3C23H23 (1)
Stoich.:	A2B3C3D23E23 (1)
Weight, g/mol:	588.173036
ΔH_f, kcal/mol:	-168.94
Dipole, Da:	7.43
IP(EA), eV:	-9.75(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[[1-[4-(4-fluoro-2-methylphenyl)phenyl]sulfonyl-2,3-dihydroindole-2-carbonyl]amino]ethoxy]-3-methylbenzoic acid

Drug info:

PubChemData

Smile

CC(C(=O)N(C1CC=C(CNC1=O)C2=CC=CC=C2)C(=O)CC3=CC(=CC(=C3)F)F)N

DOS

IR

Vibrations