Geometry & MOs

Info

ID:	313545
PubChem CID:	126615740
Reduced:	NPO6C20H28 (1)
Stoich.:	ABC6D20E28 (1)
Weight, g/mol:	529.206465
ΔH_f, kcal/mol:	-308.31
Dipole, Da:	6.81
IP(EA), eV:	-9.01(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(8-fluoro-3,4-dihydro-2H-chromen-6-yl)-5-[4-[2-(4-fluorophenyl)ethoxy]phenyl]-2,6-dimethylpyridin-3-yl]acetic acid

Drug info:

PubChemData

Smile

CCOP(=O)(C1=CC2=C(C=C1)N(C=C2C(=O)C)CC(=O)OC(C)(C)C)OCC

DOS

IR

Vibrations