Geometry & MOs

Info

ID:	263481
PubChem CID:	103371011
Reduced:	F3N3O3C11H12 (1)
Stoich.:	A3B3C3D11E12 (1)
Weight, g/mol:	292.176248
ΔH_f, kcal/mol:	-178.25
Dipole, Da:	2.33
IP(EA), eV:	-10.23(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3,3-trifluoro-2-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)oxymethyl]propanimidamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)OCC(C(=N)N)C(F)(F)F)[N+](=O)[O-]

DOS

IR

Vibrations