Geometry & MOs

Info

ID:	313919
PubChem CID:	126618941
Reduced:	N3O3C25H33 (1)
Stoich.:	A3B3C25D33 (1)
Weight, g/mol:	470.181727
ΔH_f, kcal/mol:	-100.15
Dipole, Da:	5.28
IP(EA), eV:	-8.55(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-[4-[[2-methyl-5-(trifluoromethyl)phenyl]methoxy]phenyl]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]propanoic acid

Drug info:

PubChemData

Smile

CC(CC(=O)O)CN1CCC2=NC(=NC=C2C1)C3=CC=C(C=C3)OCC4CCCCC4

DOS

IR

Vibrations