Geometry & MOs

Info

ID:	196719
PubChem CID:	78868983
Reduced:	FCl2N2O2H15C16 (1)
Stoich.:	AB2C2D2E15F16 (1)
Weight, g/mol:	385.18017
ΔH_f, kcal/mol:	-85.23
Dipole, Da:	2.78
IP(EA), eV:	-9.22(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(4-fluorophenoxy)propyl]-N,3-dimethyl-6-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CN(CCCOC1=CC=C(C=C1)F)C(=O)C2=CC(=NC(=C2)Cl)Cl

DOS

IR

Vibrations