Geometry & MOs

Info

ID:	258946
PubChem CID:	103157509
Reduced:	NO2C16H25 (1)
Stoich.:	AB2C16D25 (1)
Weight, g/mol:	261.209264
ΔH_f, kcal/mol:	-92.11
Dipole, Da:	1.77
IP(EA), eV:	-8.1(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-3-[1-(2-methylphenyl)ethylamino]propan-2-ol

Drug info:

PubChemData

Smile

COCC1=CC=CC=C1NCC(CC2CCCC2)O

DOS

IR

Vibrations