Geometry & MOs

Info

ID:	424083
PubChem CID:	135121268
Reduced:	OF3N5C22H22 (1)
Stoich.:	AB3C5D22E22 (1)
Weight, g/mol:	391.200825
ΔH_f, kcal/mol:	-96.82
Dipole, Da:	4.17
IP(EA), eV:	-8.66(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(3-methoxyphenyl)-8-pyrazolidin-3-yl-1,7-naphthyridin-2-yl]morpholine

Drug info:

PubChemData

Smile

C1CNNC1C2=NC=CC3=C2N=C(C=C3C4=CC=C(C=C4)C(F)(F)F)N5CCOCC5

DOS

IR

Vibrations