Geometry & MOs

Info

ID:	9394
PubChem CID:	89014
Reduced:	NC13H19 (1)
Stoich.:	AB13C19 (1)
Weight, g/mol:	189.15175
ΔH_f, kcal/mol:	12.4
Dipole, Da:	3.35
IP(EA), eV:	-9.17(1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-methylpent-3-enyl)cyclohex-3-ene-1-carbonitrile

Drug info:

PubChemData

Smile

CC(=CCCC1=CCC(CC1)C#N)C

DOS

IR

Vibrations