Geometry & MOs

Info

ID:	389820
PubChem CID:	134995392
Reduced:	NOH11C12 (1)
Stoich.:	ABC11D12 (1)
Weight, g/mol:	188.156501
ΔH_f, kcal/mol:	46.49
Dipole, Da:	3.76
IP(EA), eV:	-9.55(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-cyclohexylethynyl)cyclohexene

Drug info:

PubChemData

Smile

C=C=C1CN(C1=O)CC2=CC=CC=C2

DOS

IR

Vibrations