Geometry & MOs

Info

ID:	174800
PubChem CID:	75817265
Reduced:	ClN3O3H16C18 (1)
Stoich.:	AB3C3D16E18 (1)
Weight, g/mol:	362.101505
ΔH_f, kcal/mol:	-31.72
Dipole, Da:	2.24
IP(EA), eV:	-9.88(-2.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2,5-dimethylfuran-3-yl)-3-methyl-N-(4-oxopyridin-3-ylidene)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)C2=CC=C(C=C2)Cl)C(=O)N=C3C=NC=CC3=O

DOS

IR

Vibrations