Geometry & MOs

Info

ID:	172219
PubChem CID:	75481504
Reduced:	ClSN2O6H7C9 (1)
Stoich.:	ABC2D6E7F9 (1)
Weight, g/mol:	230.062219
ΔH_f, kcal/mol:	-133.99
Dipole, Da:	10.12
IP(EA), eV:	-10.55(-2.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-amino-N-(4-fluorophenyl)cyclopropane-1-carboxamide;hydrochloride

Drug info:

PubChemData

Smile

C1COC(=O)N1C2=C(C=C(C=C2)S(=O)(=O)Cl)[N+](=O)[O-]

DOS

IR

Vibrations