Geometry & MOs

Info

ID:	293778
PubChem CID:	117401100
Reduced:	NF2O4C11H11 (1)
Stoich.:	AB2C4D11E11 (1)
Weight, g/mol:	259.082013
ΔH_f, kcal/mol:	-238.85
Dipole, Da:	5.43
IP(EA), eV:	-9.54(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[6-(trifluoromethyl)-1,3-benzodioxol-5-yl]cyclobutan-1-amine

Drug info:

PubChemData

Smile

CC(C1=CC(=C2C(=C1)OCO2)C(C(=O)O)N)(F)F

DOS

IR

Vibrations