Geometry & MOs

Info

ID:	258922
PubChem CID:	103157424
Reduced:	NO4C11H19 (1)
Stoich.:	AB4C11D19 (1)
Weight, g/mol:	292.178693
ΔH_f, kcal/mol:	-198.26
Dipole, Da:	7.78
IP(EA), eV:	-9.95(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-3-[2-(4-nitrophenyl)ethylamino]propan-2-ol

Drug info:

PubChemData

Smile

COC(CC(=O)O)CN1CCCCCC1=O

DOS

IR

Vibrations