Geometry & MOs

Info

ID:	24676
PubChem CID:	612118
Reduced:	O3C23H34 (1)
Stoich.:	A3B23C34 (1)
Weight, g/mol:	358.250795
ΔH_f, kcal/mol:	-143.45
Dipole, Da:	6.15
IP(EA), eV:	-9.71(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

16-methoxy-9,13-dimethyl-7-methylidene-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosan-6-one

Drug info:

PubChemData

Smile

CC12CCC(CC1CCC3C2CCC4(C3CC5C4C(=C)C(=O)O5)C)OC

DOS

IR

Vibrations