Geometry & MOs

Info

ID:	412762
PubChem CID:	135085680
Reduced:	O5C6H12 (1)
Stoich.:	A5B6C12 (1)
Weight, g/mol:	329.98229
ΔH_f, kcal/mol:	-238.01
Dipole, Da:	1.89
IP(EA), eV:	-10.49(0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butylcyclohexane;iodozinc(1+)

Drug info:

PubChemData

Smile

C(CO)[C@@H]1C(C([C@@H](O1)O)O)O

DOS

IR

Vibrations