Geometry & MOs

Info

ID:	234411
PubChem CID:	92298376
Reduced:	IN2O2C15H19 (1)
Stoich.:	AB2C2D15E19 (1)
Weight, g/mol:	285.209264
ΔH_f, kcal/mol:	-31.77
Dipole, Da:	7.32
IP(EA), eV:	-9.09(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R,2R)-2-methylcyclohexyl]-1-phenylcyclopentane-1-carboxamide

Drug info:

PubChemData

Smile

C[C@@H]1CCC/C(=N/NC(=O)C2=CC(=C(C=C2)OC)I)/C1

DOS

IR

Vibrations