Geometry & MOs

Info

ID:	269098
PubChem CID:	103613176
Reduced:	O4N5C11H19 (1)
Stoich.:	A4B5C11D19 (1)
Weight, g/mol:	226.01452
ΔH_f, kcal/mol:	-69.99
Dipole, Da:	1.91
IP(EA), eV:	-9.62(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-(3-methyl-1,2-oxazol-5-yl)furan-2-carboxamide

Drug info:

PubChemData

Smile

CNC1=C(C(=NC=N1)NCCCOCCOC)[N+](=O)[O-]

DOS

IR

Vibrations