Geometry & MOs

Info

ID:	292416
PubChem CID:	115001312
Reduced:	NO2C13H17 (1)
Stoich.:	AB2C13D17 (1)
Weight, g/mol:	219.162314
ΔH_f, kcal/mol:	-44.02
Dipole, Da:	5.04
IP(EA), eV:	-9.57(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(cyclopentylamino)-3-phenylpropan-2-ol

Drug info:

PubChemData

Smile

CCOCCOC(CC#N)C1=CC=CC=C1

DOS

IR

Vibrations