Geometry & MOs

Info

ID:	335752
PubChem CID:	127254614
Reduced:	N2O2H9C10 (2)
Stoich.:	A2B2C9D10 (2)
Weight, g/mol:	964.401997
ΔH_f, kcal/mol:	-100.36
Dipole, Da:	7.98
IP(EA), eV:	-8.81(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bis[3-(4-benzhydrylpiperazin-1-yl)-2-hydroxypropyl] decanedioate;tetrahydrochloride

Drug info:

PubChemData

Smile

C1C2=CC=CC=C2C(=O)N1CC(=O)NCCN3C4=CC=CC=C4NC(=O)C3=O

DOS

IR

Vibrations