Geometry & MOs

Info

ID:	279043
PubChem CID:	103840717
Reduced:	N2C13H26 (1)
Stoich.:	A2B13C26 (1)
Weight, g/mol:	180.126263
ΔH_f, kcal/mol:	-35.1
Dipole, Da:	0.69
IP(EA), eV:	-8.21(2.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-methylpiperazin-1-yl)pent-4-yn-1-one

Drug info:

PubChemData

Smile

CC1CNCCN1CC2(CCCCC2)C

DOS

IR

Vibrations