Geometry & MOs

Info

ID:	315050
PubChem CID:	126624291
Reduced:	N4O4C13H28 (1)
Stoich.:	A4B4C13D28 (1)
Weight, g/mol:	320.293997
ΔH_f, kcal/mol:	-150.68
Dipole, Da:	2.59
IP(EA), eV:	-9.43(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[(2E)-2-(aminomethylimino)-1,2-dicyclohexylethylidene]amino]butan-1-amine

Drug info:

PubChemData

Smile

C(CCN=C(COCCO)/C(=N/CN)/COCCO)CN

DOS

IR

Vibrations