Geometry & MOs

Info

ID:	85803
PubChem CID:	49879387
Reduced:	FON3C18H20 (1)
Stoich.:	ABC3D18E20 (1)
Weight, g/mol:	286.095357
ΔH_f, kcal/mol:	-46.81
Dipole, Da:	4.06
IP(EA), eV:	-8.86(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-methylfuran-2-yl)methyl]-3-oxo-4H-1,4-benzoxazine-2-carboxamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)C2=CC=NC=C2)C(=O)NCC3=CC(=CC=C3)F

DOS

IR

Vibrations