Geometry & MOs

Info

ID:	435405
PubChem CID:	135191375
Reduced:	NF4O5H15C18 (1)
Stoich.:	AB4C5D15E18 (1)
Weight, g/mol:	332.06532
ΔH_f, kcal/mol:	-382.2
Dipole, Da:	6.88
IP(EA), eV:	-9.59(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-[(3Z)-3-[cyano-(2-methylphenyl)methylidene]thiophen-2-ylidene]amino] propane-1-sulfinate

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=O)O)NC(=O)CCC2=CC(=C(C=C2)OC(F)F)OC(F)F

DOS

IR

Vibrations