Geometry & MOs

Info

ID:	365524
PubChem CID:	127317972
Reduced:	O2N4C17H30 (1)
Stoich.:	A2B4C17D30 (1)
Weight, g/mol:	322.236876
ΔH_f, kcal/mol:	-114.66
Dipole, Da:	5.99
IP(EA), eV:	-8.62(1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclobutyl-N-[4-(methylcarbamoyl)cyclohexyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CN2CCCC2CN1C(=O)NC3CCC(CC3)C(=O)NC

DOS

IR

Vibrations