Geometry & MOs

Info

ID:	224394
PubChem CID:	85342468
Reduced:	SN3O3C21H33 (1)
Stoich.:	AB3C3D21E33 (1)
Weight, g/mol:	407.231427
ΔH_f, kcal/mol:	-46.04
Dipole, Da:	3.73
IP(EA), eV:	-8.69(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-N-(3,7-dimethylocta-2,6-dienyl)-2-trimethylsilylethanesulfonamide

Drug info:

PubChemData

Smile

CC12CC(CC(C1CCC34C2CCC(C3)C(C4)C=NNC(=S)N)C(=O)OC)O

DOS

IR

Vibrations