Geometry & MOs

Info

ID:	12826
PubChem CID:	146378
Reduced:	NF2O5H17C18 (1)
Stoich.:	AB2C5D17E18 (1)
Weight, g/mol:	365.107479
ΔH_f, kcal/mol:	-274.59
Dipole, Da:	8.14
IP(EA), eV:	-9.28(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-[4-(difluoromethoxy)phenyl]-2-methyl-5-oxo-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(NC2=C(C1C3=CC=C(C=C3)OC(F)F)C(=O)OC2)C

DOS

IR

Vibrations