Geometry & MOs

Info

ID:	315354
PubChem CID:	126625685
Reduced:	IO3C14H21 (1)
Stoich.:	AB3C14D21 (1)
Weight, g/mol:	392.04846
ΔH_f, kcal/mol:	-110.75
Dipole, Da:	2.58
IP(EA), eV:	-8.8(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl [4-(3-iodopropoxymethyl)phenyl] carbonate

Drug info:

PubChemData

Smile

CCOC(C)OC1=CC=C(C=C1)COCCCI

DOS

IR

Vibrations