Geometry & MOs

Info

ID:	370203
PubChem CID:	127337717
Reduced:	ON4C18H30 (1)
Stoich.:	AB4C18D30 (1)
Weight, g/mol:	353.279075
ΔH_f, kcal/mol:	-54.34
Dipole, Da:	5.78
IP(EA), eV:	-8.93(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=NC=CN1C2CCCN(C2)C(=O)NC3CCC(CC3)C

DOS

IR

Vibrations