Geometry & MOs

Info

ID:	409656
PubChem CID:	135082438
Reduced:	O4C7H9 (2)
Stoich.:	A4B7C9 (2)
Weight, g/mol:	110.10955
ΔH_f, kcal/mol:	-310.04
Dipole, Da:	4.98
IP(EA), eV:	-9.88(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	-2

Chem-info

IUPAC name:

cyclooctane

Drug info:

PubChemData

Smile

C1COCCOCC(=O)C2=C(C=C(COCCO1)OC2=O)O

DOS

IR

Vibrations