Geometry & MOs

Info

ID:	45319
PubChem CID:	10511136
Reduced:	O3C8H14 (1)
Stoich.:	A3B8C14 (1)
Weight, g/mol:	159.104799
ΔH_f, kcal/mol:	-159.02
Dipole, Da:	3.13
IP(EA), eV:	-10.47(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(2-ethenylcyclohexen-1-yl)prop-2-enenitrile

Drug info:

PubChemData

Smile

CCOC(=O)[C@H]1CCC[C@H]1O

DOS

IR

Vibrations