Geometry & MOs

Info

ID:	327392
PubChem CID:	126689781
Reduced:	S2O5C51H70 (1)
Stoich.:	A2B5C51D70 (1)
Weight, g/mol:	288.0375
ΔH_f, kcal/mol:	-190.79
Dipole, Da:	2.08
IP(EA), eV:	-8.25(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-iodo-5,5-dimethyltricyclo[5.2.1.03,9]dec-3-ene

Drug info:

PubChemData

Smile

CCCCCCCCCCCCC1=CC2=C(O1)C3=C(C2(OCCCC)OCCCC)C=C4C=C5C(=CC4=C3)C(C6=C5SC7=C6SC(=C7)C)(OCCCC)OCCCC

DOS

IR

Vibrations