Geometry & MOs

Info

ID:	379575
PubChem CID:	134446491
Reduced:	OSN6C22H22 (1)
Stoich.:	ABC6D22E22 (1)
Weight, g/mol:	392.23246
ΔH_f, kcal/mol:	82.37
Dipole, Da:	6.35
IP(EA), eV:	-8.8(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(4-ethylpiperidin-1-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine

Drug info:

PubChemData

Smile

CC1=CC(=NC=C1C2=CC(=NC3=C2C=CN=C3C4=CC=NN4)N5CCOCC5)SC

DOS

IR

Vibrations