Geometry & MOs

Info

ID:	35152
PubChem CID:	7979391
Reduced:	FNSO4H18C21 (1)
Stoich.:	ABCD4E18F21 (1)
Weight, g/mol:	339.984004
ΔH_f, kcal/mol:	-150.72
Dipole, Da:	4.28
IP(EA), eV:	-9.34(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]thiophene-2-carbohydrazide

Drug info:

PubChemData

Smile

C1C[C@@]2(N(C1=O)[C@@H](CS2)C(=O)OCC(=O)C3=CC=C(C=C3)F)C4=CC=CC=C4

DOS

IR

Vibrations