Geometry & MOs

Info

ID:	338555
PubChem CID:	127259566
Reduced:	N2O3H8C10 (1)
Stoich.:	A2B3C8D10 (1)
Weight, g/mol:	164.094963
ΔH_f, kcal/mol:	1.88
Dipole, Da:	3.85
IP(EA), eV:	-8.97(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(Z)-(2-oxocyclohexylidene)methyl]amino]acetonitrile

Drug info:

PubChemData

Smile

C1OC2=C(O1)C=C(C=C2)/C=N/OCC#N

DOS

IR

Vibrations