Geometry & MOs

Info

ID:	69400
PubChem CID:	47169896
Reduced:	ClNOC7H7 (2)
Stoich.:	ABCD7E7 (2)
Weight, g/mol:	300.077993
ΔH_f, kcal/mol:	-29.87
Dipole, Da:	5.39
IP(EA), eV:	-9.76(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(1,1-dioxothiolane-3-carbonyl)-5-ethylfuran-2-carbohydrazide

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)CN(C)C(=O)C2=C(C(=CC=C2)Cl)Cl

DOS

IR

Vibrations