Geometry & MOs

Info

ID:	24714
PubChem CID:	612541
Reduced:	IC9H11 (1)
Stoich.:	AB9C11 (1)
Weight, g/mol:	245.99055
ΔH_f, kcal/mol:	20.43
Dipole, Da:	2.43
IP(EA), eV:	-9.19(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-iodo-4-propylbenzene

Drug info:

PubChemData

Smile

CCCC1=CC=C(C=C1)I

DOS

IR

Vibrations