Geometry & MOs

Info

ID:	259151
PubChem CID:	103158391
Reduced:	ClNOF3C15H19 (1)
Stoich.:	ABCD3E15F19 (1)
Weight, g/mol:	304.134241
ΔH_f, kcal/mol:	-219.9
Dipole, Da:	3.95
IP(EA), eV:	-9.06(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(5-chloroquinolin-8-yl)amino]-3-cyclopentylpropan-2-ol

Drug info:

PubChemData

Smile

C1CCC(C1)CC(CNC2=CC(=CC(=C2)C(F)(F)F)Cl)O

DOS

IR

Vibrations