Geometry & MOs

Info

ID:	405841
PubChem CID:	135075603
Reduced:	O2C6H9 (2)
Stoich.:	A2B6C9 (2)
Weight, g/mol:	418.098737
ΔH_f, kcal/mol:	-178.02
Dipole, Da:	3.22
IP(EA), eV:	-10.04(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

chloro-[(1S)-3-(3-hydroxypropyl)-2,2,4-trimethylcyclohex-3-en-1-yl]mercury

Drug info:

PubChemData

Smile

CCOC(=O)C1=C[C@@H]([C@H](C(=O)O1)C(C)C)C

DOS

IR

Vibrations