Geometry & MOs

Info

ID:	9089
PubChem CID:	85907
Reduced:	O3C8H13 (2)
Stoich.:	A3B8C13 (2)
Weight, g/mol:	314.172939
ΔH_f, kcal/mol:	-302.83
Dipole, Da:	4.72
IP(EA), eV:	-10.53(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dicyclohexyl 2,3-dihydroxybutanedioate

Drug info:

PubChemData

Smile

C1CCC(CC1)OC(=O)C(C(C(=O)OC2CCCCC2)O)O

DOS

IR

Vibrations