Geometry & MOs

Info

ID:	445802
PubChem CID:	135269619
Reduced:	O3N4C20H24 (1)
Stoich.:	A3B4C20D24 (1)
Weight, g/mol:	433.200156
ΔH_f, kcal/mol:	-34.32
Dipole, Da:	4.91
IP(EA), eV:	-9.26(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[(3S)-4-[2-(furan-3-yl)benzoyl]-3,5-dimethylpiperazin-1-yl]methyl]-N-hydroxybenzamide

Drug info:

PubChemData

Smile

CC1CN(CC(N1C(=O)C2=CC=CC=N2)C)CC3=CC=C(C=C3)C(=O)NO

DOS

IR

Vibrations