Geometry & MOs

Info

ID:	194672
PubChem CID:	78572726
Reduced:	ClNF3O3H13C15 (1)
Stoich.:	ABC3D3E13F15 (1)
Weight, g/mol:	376.072907
ΔH_f, kcal/mol:	-253.47
Dipole, Da:	7.88
IP(EA), eV:	-9.34(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(4-acetylphenyl)sulfonyl-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide

Drug info:

PubChemData

Smile

CC=CC=CC(=O)OCC(=O)NC1=C(C=CC(=C1)C(F)(F)F)Cl

DOS

IR

Vibrations