Geometry & MOs

Info

ID:	396696
PubChem CID:	135029044
Reduced:	NOSiC17H23 (1)
Stoich.:	ABCD17E23 (1)
Weight, g/mol:	278.188195
ΔH_f, kcal/mol:	-32.54
Dipole, Da:	2.33
IP(EA), eV:	-9.19(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aS,5aR,6R,7R,9aR,9bS)-7-hydroxy-6,9a,9b-trimethyl-1-oxo-3,3a,4,5,5a,7,8,9-octahydro-2H-cyclopenta[a]naphthalene-6-carbaldehyde

Drug info:

PubChemData

Smile

C[Si](C)(C)OC1=C[C@H]2CCC1C3(N2C3)C4=CC=CC=C4

DOS

IR

Vibrations