Geometry & MOs

Info

ID:	150334
PubChem CID:	53790022
Reduced:	OC4H6 (5)
Stoich.:	AB4C6 (5)
Weight, g/mol:	350.209324
ΔH_f, kcal/mol:	-238.85
Dipole, Da:	5.66
IP(EA), eV:	-9.95(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7S,8S)-8-[2-[(4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-7-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-1,3-dicarbaldehyde

Drug info:

PubChemData

Smile

C[C@H]1CCC2C[C@H](CC(C2[C@H]1CCC3C[C@H](CC(=O)O3)O)C=O)C=O

DOS

IR

Vibrations