Geometry & MOs

Info

ID:	283237
PubChem CID:	103966797
Reduced:	ON2C18H30 (1)
Stoich.:	AB2C18D30 (1)
Weight, g/mol:	248.188863
ΔH_f, kcal/mol:	-82.15
Dipole, Da:	2.99
IP(EA), eV:	-9.87(0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyano-N-(3,3,5,5-tetramethylcyclohexyl)cyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CC1(CC(CC(C1)(C)C)NC(=O)C2(CCCCC2)C#N)C

DOS

IR

Vibrations