Geometry & MOs

Info

ID:	379574
PubChem CID:	134446480
Reduced:	FO2N6C27H29 (1)
Stoich.:	AB2C6D27E29 (1)
Weight, g/mol:	418.157581
ΔH_f, kcal/mol:	-15.71
Dipole, Da:	3.82
IP(EA), eV:	-8.59(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(4-methyl-6-methylsulfanylpyridin-3-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine

Drug info:

PubChemData

Smile

CC1COCCN1C2=NC3=C(C=CN=C3C4=CC=NN4C5CCCCO5)C(=C2)C6=C(C(=CC=C6)F)N

DOS

IR

Vibrations