Geometry & MOs

Info

ID:	259047
PubChem CID:	103158083
Reduced:	NO3C12H23 (1)
Stoich.:	AB3C12D23 (1)
Weight, g/mol:	265.184193
ΔH_f, kcal/mol:	-163.96
Dipole, Da:	2.86
IP(EA), eV:	-9.41(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-3-[[(1R)-1-(3-fluorophenyl)ethyl]amino]propan-2-ol

Drug info:

PubChemData

Smile

CC1CCC(CC1)OC(=O)CC(CN)OC

DOS

IR

Vibrations