Geometry & MOs

Info

ID:	404838
PubChem CID:	135071388
Reduced:	SO4C23H32 (1)
Stoich.:	AB4C23D32 (1)
Weight, g/mol:	431.176644
ΔH_f, kcal/mol:	-138.79
Dipole, Da:	6.42
IP(EA), eV:	-8.91(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(7-methyl-1-phenyloct-6-en-3-yl)-methylsulfonylamino] phenyl carbonate

Drug info:

PubChemData

Smile

CCC(=C(C(C)(C)S(=O)(=O)C1=CC=C(C=C1)C)OCC)CCCC2=CC=CO2

DOS

IR

Vibrations