Geometry & MOs

Info

ID:	1645
PubChem CID:	4816
Reduced:	O6C15H16 (1)
Stoich.:	A6B15C16 (1)
Weight, g/mol:	292.094688
ΔH_f, kcal/mol:	-195.92
Dipole, Da:	7.41
IP(EA), eV:	-10.41(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-hydroxy-13-methyl-14-prop-1-en-2-yl-4,7,10-trioxapentacyclo[6.4.1.19,12.03,5.05,13]tetradecane-6,11-dione

Drug info:

PubChemData

Smile

CC(=C)C1C2C3C4(C(C1C(=O)O2)(CC5C4(O5)C(=O)O3)O)C

DOS

IR

Vibrations