Geometry & MOs

Info

ID:	445791
PubChem CID:	135269571
Reduced:	ON2C13H17 (2)
Stoich.:	AB2C13D17 (2)
Weight, g/mol:	343.189592
ΔH_f, kcal/mol:	-1.14
Dipole, Da:	4.67
IP(EA), eV:	-8.76(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CN(CC(N1CC2=CC=CC=C2C3=CCNCC3)C)CC4=CC=C(C=C4)C(=O)NO

DOS

IR

Vibrations