Geometry & MOs

Info

ID:	387975
PubChem CID:	134987607
Reduced:	NO4C10H15 (1)
Stoich.:	AB4C10D15 (1)
Weight, g/mol:	169.065827
ΔH_f, kcal/mol:	-159.73
Dipole, Da:	4.27
IP(EA), eV:	-9.77(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-2-chloro-2-isocyanoethenyl]cyclohexane

Drug info:

PubChemData

Smile

COC(=O)[C@H]1[C@@H](CCN1C(=O)OC)C=C

DOS

IR

Vibrations