Geometry & MOs

Info

ID:	332267
PubChem CID:	127250553
Reduced:	FO2N4H21C22 (1)
Stoich.:	AB2C4D21E22 (1)
Weight, g/mol:	404.184841
ΔH_f, kcal/mol:	-37.16
Dipole, Da:	2.93
IP(EA), eV:	-8.74(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[6-(4-methoxyphenyl)pyridin-2-yl]morpholin-4-yl]-[2-(methylamino)pyridin-4-yl]methanone

Drug info:

PubChemData

Smile

CNC1=NC=CC(=C1)C(=O)N2CCOC(C2)C3=CC=CC(=N3)C4=CC(=CC=C4)F

DOS

IR

Vibrations