Geometry & MOs

Info

ID:	445775
PubChem CID:	135269460
Reduced:	IN2O2C22H27 (1)
Stoich.:	AB2C2D22E27 (1)
Weight, g/mol:	367.225977
ΔH_f, kcal/mol:	-28.94
Dipole, Da:	3.43
IP(EA), eV:	-8.72(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(4-benzyl-3,5-dimethylpiperazin-1-yl)methyl]phenyl]-N-hydroxyacetamide

Drug info:

PubChemData

Smile

C[C@H]1CN(CC(N1CC2=CC=CC=C2I)C)CC3=CC=C(C=C3)C(=O)OC

DOS

IR

Vibrations