Geometry & MOs

Info

ID:	309693
PubChem CID:	126554983
Reduced:	FO2N8H23C27 (1)
Stoich.:	AB2C8D23E27 (1)
Weight, g/mol:	439.155686
ΔH_f, kcal/mol:	100.94
Dipole, Da:	13.61
IP(EA), eV:	-8.83(-2.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-fluoro-5-[2-[2-(1-methylpyrazol-4-yl)-5,6-dihydro-1,7-naphthyridin-8-yl]-3H-imidazo[4,5-c]pyridin-7-yl]phenol

Drug info:

PubChemData

Smile

CN(C)CCOC1=CN=CC(=C1)C2=NC\3=C(C=C2)NN/C3=C/4\N=C5C=NC=C(C5=N4)C6=CC(=CC(=C6)F)O

DOS

IR

Vibrations