Geometry & MOs

Info

ID:	315335
PubChem CID:	126625642
Reduced:	IO3C14H25 (1)
Stoich.:	AB3C14D25 (1)
Weight, g/mol:	318.01168
ΔH_f, kcal/mol:	-176.66
Dipole, Da:	1.6
IP(EA), eV:	-9.75(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-iodopropyl)-2,2-dimethyl-1,3-benzodioxole

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)OC1CCCC(C1)CCCI

DOS

IR

Vibrations