Geometry & MOs

Info

ID:	273836
PubChem CID:	103805301
Reduced:	ClFION2H9C13 (1)
Stoich.:	ABCDE2F9G13 (1)
Weight, g/mol:	260.132491
ΔH_f, kcal/mol:	-30.68
Dipole, Da:	0.84
IP(EA), eV:	-8.55(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-amino-2-fluorophenyl)tricyclo[3.2.1.02,4]octane-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1N)NC(=O)C2=C(C=CC(=C2)Cl)I)F

DOS

IR

Vibrations