Geometry & MOs

Info

ID:	20622
PubChem CID:	584886
Reduced:	N2C19H26 (1)
Stoich.:	A2B19C26 (1)
Weight, g/mol:	282.209599
ΔH_f, kcal/mol:	14.92
Dipole, Da:	4.74
IP(EA), eV:	-10.53(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-adamantyl)-2-cyclohexylpropanedinitrile

Drug info:

PubChemData

Smile

C1CCC(CC1)C(C#N)(C#N)C2C3CC4CC(C3)CC2C4

DOS

IR

Vibrations