Geometry & MOs

Info

ID:	63009
PubChem CID:	26737975
Reduced:	NO2C15H23 (1)
Stoich.:	AB2C15D23 (1)
Weight, g/mol:	249.172879
ΔH_f, kcal/mol:	-106.27
Dipole, Da:	3.59
IP(EA), eV:	-9.06(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-2,5-dimethylfuran-3-carboxamide

Drug info:

PubChemData

Smile

C[C@@H]1CCC[C@H]([C@@H]1C)NC(=O)C2=C(OC(=C2)C)C

DOS

IR

Vibrations