Geometry & MOs

Info

ID:	294334
PubChem CID:	117453384
Reduced:	N2O4H10C15 (1)
Stoich.:	A2B4C10D15 (1)
Weight, g/mol:	282.090352
ΔH_f, kcal/mol:	-49.04
Dipole, Da:	8.38
IP(EA), eV:	-9.19(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(7-fluoro-6-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)cyclobutane-1-carboxylic acid

Drug info:

PubChemData

Smile

CN1C(=CC(=N1)C(=O)O)C2=C3C(=CC4=C2C=CO4)C=CO3

DOS

IR

Vibrations