Geometry & MOs

Info

ID:	224762
PubChem CID:	85349342
Reduced:	PN2O5C9H15 (1)
Stoich.:	AB2C5D9E15 (1)
Weight, g/mol:	266.151809
ΔH_f, kcal/mol:	-210.26
Dipole, Da:	3.45
IP(EA), eV:	-9.81(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,5,8-trimethyl-9-methylidene-12-oxatetracyclo[6.4.0.01,11.03,7]dodecane-2,6,10-triol

Drug info:

PubChemData

Smile

CC(=C(C(=O)C(=[N+]=[N-])P(=O)(OC)OC)OC)C

DOS

IR

Vibrations