Geometry & MOs

Info

ID:	7670
PubChem CID:	73687
Reduced:	O2C15H22 (1)
Stoich.:	A2B15C22 (1)
Weight, g/mol:	234.16198
ΔH_f, kcal/mol:	-82.4
Dipole, Da:	5.11
IP(EA), eV:	-9.71(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,4aR,8aR)-5,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalene-1,2-dicarbaldehyde

Drug info:

PubChemData

Smile

C[C@@]12CCCC([C@H]1CC=C([C@H]2C=O)C=O)(C)C

DOS

IR

Vibrations