Geometry & MOs

Info

ID:	424084
PubChem CID:	135121272
Reduced:	O2N5C22H25 (1)
Stoich.:	A2B5C22D25 (1)
Weight, g/mol:	391.200825
ΔH_f, kcal/mol:	19.15
Dipole, Da:	6.0
IP(EA), eV:	-8.47(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)C2=CC(=NC3=C2C=CN=C3C4CCNN4)N5CCOCC5

DOS

IR

Vibrations