Geometry & MOs

Info

ID:	315334
PubChem CID:	126625641
Reduced:	IO2C14H19 (1)
Stoich.:	AB2C14D19 (1)
Weight, g/mol:	368.08484
ΔH_f, kcal/mol:	-88.09
Dipole, Da:	2.53
IP(EA), eV:	-9.82(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl [3-(3-iodopropyl)cyclohexyl] carbonate

Drug info:

PubChemData

Smile

CC(CI)C1=CC=C(C=C1)C(=O)OC(C)(C)C

DOS

IR

Vibrations