Geometry & MOs

Info

ID:	318355
PubChem CID:	126650646
Reduced:	FO2N5C29H36 (1)
Stoich.:	AB2C5D29E36 (1)
Weight, g/mol:	434.200571
ΔH_f, kcal/mol:	-73.58
Dipole, Da:	6.11
IP(EA), eV:	-8.15(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-fluoro-2-(4-phenylmethoxyphenyl)-7,8-dihydro-5H-1,6-naphthyridin-6-yl] 2-methylbutanoate

Drug info:

PubChemData

Smile

CC(C)N1CCN(CC1)C2=CC=C(C=C2)C3=CC4=C(C=C3)N5C=C(N=C5CO4)CN6CCC(CC6)(O)F

DOS

IR

Vibrations