Geometry & MOs

Info

ID:	258822
PubChem CID:	103157140
Reduced:	N2O4C13H18 (1)
Stoich.:	A2B4C13D18 (1)
Weight, g/mol:	251.168543
ΔH_f, kcal/mol:	-155.58
Dipole, Da:	8.85
IP(EA), eV:	-9.94(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-3-(4-fluoro-2-methylanilino)propan-2-ol

Drug info:

PubChemData

Smile

COC(CC(=O)O)CNC(=O)[C@H](C1=CC=CC=C1)N

DOS

IR

Vibrations