Geometry & MOs

Info

ID:	399537
PubChem CID:	135040791
Reduced:	OC13H22 (1)
Stoich.:	AB13C22 (1)
Weight, g/mol:	271.193614
ΔH_f, kcal/mol:	-60.23
Dipole, Da:	1.97
IP(EA), eV:	-9.91(1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[(3S)-3-methylcyclopenten-1-yl]methyl]-N-[(1S)-1-phenylethyl]propanamide

Drug info:

PubChemData

Smile

C=C[C@@]12CCCC[C@H]1[C@H](CCC2)CO

DOS

IR

Vibrations