Geometry & MOs

Info

ID:	332312
PubChem CID:	127250598
Reduced:	ON5H21C22 (1)
Stoich.:	AB5C21D22 (1)
Weight, g/mol:	443.220892
ΔH_f, kcal/mol:	87.2
Dipole, Da:	2.98
IP(EA), eV:	-8.84(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[6-[4-[(2,2-dimethyl-3H-1-benzofuran-5-yl)methyl]morpholin-2-yl]pyridin-2-yl]benzamide

Drug info:

PubChemData

Smile

C1COC(CN1CC2=C3C=CC=NC3=CC=C2)C4=CC=CC(=N4)C5=CNN=C5

DOS

IR

Vibrations