Geometry & MOs

Info

ID:	405231
PubChem CID:	135073070
Reduced:	NO6H19C20 (1)
Stoich.:	AB6C19D20 (1)
Weight, g/mol:	264.154787
ΔH_f, kcal/mol:	-95.08
Dipole, Da:	5.03
IP(EA), eV:	-9.05(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-dec-1-enyl]sulfinylbenzene

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2OCC3[C@@H](O2)[C@@H](C=CO3)OC(=O)C4=CC=CC=N4

DOS

IR

Vibrations