Geometry & MOs

Info

ID:	389555
PubChem CID:	134993711
Reduced:	NC17H29 (1)
Stoich.:	AB17C29 (1)
Weight, g/mol:	233.141579
ΔH_f, kcal/mol:	-13.09
Dipole, Da:	2.89
IP(EA), eV:	-8.75(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclohexyl-4-(4-iminobutyl)cyclobut-3-ene-1,2-dione

Drug info:

PubChemData

Smile

CCCC1=C(C(=N)C(=C1CCC)CCC)CCC

DOS

IR

Vibrations