Geometry & MOs

Info

ID:	144465
PubChem CID:	53372836
Reduced:	ClFN5H11C20 (1)
Stoich.:	ABC5D11E20 (1)
Weight, g/mol:	394.1109
ΔH_f, kcal/mol:	106.57
Dipole, Da:	4.18
IP(EA), eV:	-9.58(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2-N,2-N-dimethylpyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

C1=CC2=C(N=C1)N=C(C=C2N3C=CC4=CN=CN=C43)C5=C(C=CC(=C5)Cl)F

DOS

IR

Vibrations