Geometry & MOs

Info

ID:	163978
PubChem CID:	74381167
Reduced:	SO5C21H30 (1)
Stoich.:	AB5C21D30 (1)
Weight, g/mol:	2510.228249
ΔH_f, kcal/mol:	-208.44
Dipole, Da:	5.98
IP(EA), eV:	-9.23(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC=C1C(CC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)OS(=O)(=O)O

DOS

IR

Vibrations