Geometry & MOs

Info

ID:	173678
PubChem CID:	75668073
Reduced:	ClF2N2O3H9C17 (1)
Stoich.:	AB2C2D3E9F17 (1)
Weight, g/mol:	440.04718
ΔH_f, kcal/mol:	-96.35
Dipole, Da:	6.24
IP(EA), eV:	-9.3(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(5-chloro-2-methoxyphenyl)-[1-(5-methyl-1,3,4-thiadiazol-2-yl)-4,5-dioxo-2-phenylpyrrolidin-3-ylidene]methanolate

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C2=C3C(C(=O)N(C3=O)C4=C(C=C(C=C4)F)F)ON2)Cl

DOS

IR

Vibrations