Geometry & MOs

Info

ID:	362351
PubChem CID:	127307420
Reduced:	OSN6C17H30 (1)
Stoich.:	ABC6D17E30 (1)
Weight, g/mol:	366.274324
ΔH_f, kcal/mol:	-6.76
Dipole, Da:	3.87
IP(EA), eV:	-8.53(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1,4-dimethylpiperazin-2-yl)methyl]-4-(2-pyrrolidin-1-ylacetyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CN1CCN(C(C1)CNC(=O)N2CCCN(CC2)CC3=CSC=N3)C

DOS

IR

Vibrations