Geometry & MOs

Info

ID:	387003
PubChem CID:	134983654
Reduced:	O5C14H20 (1)
Stoich.:	A5B14C20 (1)
Weight, g/mol:	260.17763
ΔH_f, kcal/mol:	-193.8
Dipole, Da:	4.72
IP(EA), eV:	-9.39(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

COC[C@H]1C[C@H](C=CC=C1)C(C(=O)OC)C(=O)OC

DOS

IR

Vibrations