Geometry & MOs

Info

ID:	258887
PubChem CID:	103157344
Reduced:	NO2C5H9 (2)
Stoich.:	AB2C5D9 (2)
Weight, g/mol:	248.188863
ΔH_f, kcal/mol:	-166.56
Dipole, Da:	7.11
IP(EA), eV:	-9.64(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-3-(2-pyridin-4-ylethylamino)propan-2-ol

Drug info:

PubChemData

Smile

COC(CC(=O)O)CNC(=O)CNCC=C

DOS

IR

Vibrations