Geometry & MOs

Info

ID:	392548
PubChem CID:	135017133
Reduced:	NO2H11C12 (2)
Stoich.:	AB2C11D12 (2)
Weight, g/mol:	276.079787
ΔH_f, kcal/mol:	-96.55
Dipole, Da:	2.7
IP(EA), eV:	-9.25(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-fluoro-4-phenylmethoxy-3a,4,7,7a-tetrahydro-2-benzofuran-1,3-dione

Drug info:

PubChemData

Smile

CC(=O)OC1=CC=CC=C1C2=NC3=C(CCCC3)N=C2C4=CC=CC=C4OC(=O)C

DOS

IR

Vibrations