Geometry & MOs

Info

ID:	321215
PubChem CID:	126665382
Reduced:	F2O2N7C20H23 (1)
Stoich.:	A2B2C7D20E23 (1)
Weight, g/mol:	510.090183
ΔH_f, kcal/mol:	-84.85
Dipole, Da:	8.65
IP(EA), eV:	-9.02(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-1-(6-chloro-2-hydroxynaphthalen-1-yl)-4,4-dipyridin-4-yl-1H-naphthalen-2-ol

Drug info:

PubChemData

Smile

CCN1C[C@H]([C@@H](C1)O)NC2=NC=NC3=NNC(=C32)C(=O)N[C@H](C)C4=C(C=CC(=C4)F)F

DOS

IR

Vibrations