Geometry & MOs

Info

ID:	189430
PubChem CID:	77854406
Reduced:	ClO2C23H31 (1)
Stoich.:	AB2C23D31 (1)
Weight, g/mol:	324.23006
ΔH_f, kcal/mol:	-75.25
Dipole, Da:	7.87
IP(EA), eV:	-9.91(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1'-(1-hydroxy-4-methyloct-1-enyl)spiro[1,3-dioxolane-2,5'-2,3,3a,4,6,6a-hexahydro-1H-pentalene]-2'-ol

Drug info:

PubChemData

Smile

CC(=O)C1C(CC2C1(CCC3C2CCC4=CC(=O)C(CC34C)Cl)C)C=C

DOS

IR

Vibrations