Geometry & MOs

Info

ID:	375881
PubChem CID:	134221875
Reduced:	FNOH24C25 (1)
Stoich.:	ABCD24E25 (1)
Weight, g/mol:	491.186336
ΔH_f, kcal/mol:	-44.19
Dipole, Da:	5.0
IP(EA), eV:	-8.29(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[1-(4-chlorobenzoyl)-6-methyl-4-(4-methylphenyl)-2,3-dihydroindol-5-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acid

Drug info:

PubChemData

Smile

CCC1=C(C2=C(C=C1C)N(CC2)C(=O)C3=CC=CC=C3F)C4=CC=C(C=C4)C

DOS

IR

Vibrations