Geometry & MOs

Info

ID:	444770
PubChem CID:	135263516
Reduced:	NOC7H9 (2)
Stoich.:	ABC7D9 (2)
Weight, g/mol:	528.310041
ΔH_f, kcal/mol:	-61.86
Dipole, Da:	4.47
IP(EA), eV:	-8.36(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(4-acetylpiperazin-1-yl)phenyl]-N-[(5-methylfuran-2-yl)-(4-methyl-2-piperidin-1-ylphenyl)methyl]acetamide

Drug info:

PubChemData

Smile

CC(CC1=CNC2=CC=CC=C21)NCCC(=O)O

DOS

IR

Vibrations