Geometry & MOs

Info

ID:	383566
PubChem CID:	134975356
Reduced:	ClSiO5C13H21 (1)
Stoich.:	ABC5D13E21 (1)
Weight, g/mol:	240.040066
ΔH_f, kcal/mol:	-268.76
Dipole, Da:	3.12
IP(EA), eV:	-8.93(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-chloro-1,3,4,5-tetrahydroxycyclohexane-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OC1[C@@H]2C[C@@](C(C1=O)Cl)(C(=O)O2)O

DOS

IR

Vibrations