Geometry & MOs

Info

ID:	43563
PubChem CID:	10321472
Reduced:	NF3O5H22C23 (1)
Stoich.:	AB3C5D22E23 (1)
Weight, g/mol:	449.127466
ΔH_f, kcal/mol:	-299.81
Dipole, Da:	6.88
IP(EA), eV:	-9.32(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-[4-[(3,5-dimethoxyphenyl)methoxy]phenyl]-5-fluoroindol-3-yl]-2-oxoacetic acid

Drug info:

PubChemData

Smile

CCO[C@@H](CC1=C(C=C(C=C1)OCC2=C(OC(=N2)C3=CC=CC=C3)C)C(F)(F)F)C(=O)O

DOS

IR

Vibrations