Geometry & MOs

Info

ID:	149884
PubChem CID:	53789564
Reduced:	NOC21H27 (1)
Stoich.:	ABC21D27 (1)
Weight, g/mol:	510.28422
ΔH_f, kcal/mol:	-42.82
Dipole, Da:	4.93
IP(EA), eV:	-8.67(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(formamidomethoxy)-N-methyl-N-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxohexoxy]phenyl]benzamide

Drug info:

PubChemData

Smile

CC(C)CC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)CC(C)C

DOS

IR

Vibrations