Geometry & MOs

Info

ID:	45620
PubChem CID:	10515713
Reduced:	ClFNSH7C13 (1)
Stoich.:	ABCDE7F13 (1)
Weight, g/mol:	263.98113
ΔH_f, kcal/mol:	19.66
Dipole, Da:	3.56
IP(EA), eV:	-8.96(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-fluoro-2-(3-iodopropyl)benzene

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=NC3=C(S2)C(=CC=C3)F)Cl

DOS

IR

Vibrations