Geometry & MOs

Info

ID:	362921
PubChem CID:	127309857
Reduced:	ON3C7H13 (2)
Stoich.:	AB3C7D13 (2)
Weight, g/mol:	313.247775
ΔH_f, kcal/mol:	-44.42
Dipole, Da:	5.73
IP(EA), eV:	-8.18(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1CCN(C(C1)CNC(=O)NC2=NN(C=C2)CCOC)C

DOS

IR

Vibrations