Geometry & MOs

Info

ID:	259054
PubChem CID:	103158105
Reduced:	NO2C17H27 (1)
Stoich.:	AB2C17D27 (1)
Weight, g/mol:	261.209264
ΔH_f, kcal/mol:	-94.25
Dipole, Da:	4.2
IP(EA), eV:	-8.74(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C[C@@H](C1=CC(=CC=C1)OC)NCC(CC2CCCC2)O

DOS

IR

Vibrations