Geometry & MOs

Info

ID:	222250
PubChem CID:	85295674
Reduced:	N2O5C12H18 (1)
Stoich.:	A2B5C12D18 (1)
Weight, g/mol:	270.125594
ΔH_f, kcal/mol:	-197.56
Dipole, Da:	5.08
IP(EA), eV:	-9.73(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-9-methyl-10-phenyl-4-oxatricyclo[4.3.1.03,7]dec-8-en-2-one

Drug info:

PubChemData

Smile

CC1C(C(C(C(N1)CNC(=O)C2=COC=C2)O)O)O

DOS

IR

Vibrations