Geometry & MOs

Info

ID:	283238
PubChem CID:	103966798
Reduced:	ON2C15H24 (1)
Stoich.:	AB2C15D24 (1)
Weight, g/mol:	270.209599
ΔH_f, kcal/mol:	-43.97
Dipole, Da:	3.12
IP(EA), eV:	-10.01(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-2-[(3,3,5,5-tetramethylcyclohexyl)amino]benzonitrile

Drug info:

PubChemData

Smile

CC1(CC(CC(C1)(C)C)NC(=O)C2(CC2)C#N)C

DOS

IR

Vibrations