Geometry & MOs

Info

ID:	354709
PubChem CID:	127287408
Reduced:	ON3C17H31 (1)
Stoich.:	AB3C17D31 (1)
Weight, g/mol:	225.184112
ΔH_f, kcal/mol:	-86.21
Dipole, Da:	4.13
IP(EA), eV:	-8.65(1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-(2-methylcyclopentyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCCC1NC(=O)N2CCC(CC2)N3CCCCC3

DOS

IR

Vibrations