Geometry & MOs

Info

ID:	362341
PubChem CID:	127307406
Reduced:	O2N5C20H37 (1)
Stoich.:	A2B5C20D37 (1)
Weight, g/mol:	339.263425
ΔH_f, kcal/mol:	-111.46
Dipole, Da:	5.5
IP(EA), eV:	-8.6(1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-[(1,4-dimethylpiperazin-2-yl)methyl]-3-N-propylpiperidine-1,3-dicarboxamide

Drug info:

PubChemData

Smile

CN1CCN(C(C1)CNC(=O)N2CCCN(CC2)C(=O)CC3CCCC3)C

DOS

IR

Vibrations