Geometry & MOs

Info

ID:	205630
PubChem CID:	80129264
Reduced:	ON6C9H14 (1)
Stoich.:	AB6C9D14 (1)
Weight, g/mol:	299.1333
ΔH_f, kcal/mol:	82.13
Dipole, Da:	8.66
IP(EA), eV:	-9.59(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(2,5-difluoro-4-methylphenyl)ethyl-methylamino]oxolane-3-carboxylic acid

Drug info:

PubChemData

Smile

CCCNCCOC1=NN2C(=NN=N2)C=C1

DOS

IR

Vibrations