Geometry & MOs

Info

ID:	159739
PubChem CID:	57288686
Reduced:	FN2S2O3H11C15 (1)
Stoich.:	AB2C2D3E11F15 (1)
Weight, g/mol:	196.14633
ΔH_f, kcal/mol:	-89.88
Dipole, Da:	2.67
IP(EA), eV:	-9.19(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl undeca-5,9-dienoate

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)N2C(=CSC2=O)C3=CC=C(C=C3)S(=O)(=O)N)F

DOS

IR

Vibrations