Geometry & MOs

Info

ID:	22239
PubChem CID:	596360
Reduced:	O5C21H30 (1)
Stoich.:	A5B21C30 (1)
Weight, g/mol:	362.209324
ΔH_f, kcal/mol:	-246.07
Dipole, Da:	2.3
IP(EA), eV:	-9.87(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(8a-methyl-8-oxo-1,2,3,4,4a,5,6,7-octahydronaphthalen-1-yl) 4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylate

Drug info:

PubChemData

Smile

CC1(C2(CCC1(OC2=O)C(=O)OC3CCCC4C3(C(=O)CCC4)C)C)C

DOS

IR

Vibrations