Geometry & MOs

Info

ID:	258779
PubChem CID:	103156965
Reduced:	N4O5C12H18 (1)
Stoich.:	A4B5C12D18 (1)
Weight, g/mol:	233.177964
ΔH_f, kcal/mol:	-147.7
Dipole, Da:	9.87
IP(EA), eV:	-10.01(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(benzylamino)-3-cyclopentylpropan-2-ol

Drug info:

PubChemData

Smile

COC(CC(=O)O)CNC(=O)C1=NOC(=N1)C2CCCN2

DOS

IR

Vibrations