Geometry & MOs

Info

ID:	331987
PubChem CID:	127250273
Reduced:	ClN2O2H19C22 (1)
Stoich.:	AB2C2D19E22 (1)
Weight, g/mol:	387.158292
ΔH_f, kcal/mol:	-5.98
Dipole, Da:	4.25
IP(EA), eV:	-9.42(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[6-(4-benzoylmorpholin-2-yl)pyridin-3-yl]benzamide

Drug info:

PubChemData

Smile

C1COC(CN1C(=O)C2=CC=CC=C2)C3=NC=C(C=C3)C4=CC(=CC=C4)Cl

DOS

IR

Vibrations