Geometry & MOs

Info

ID:	235130
PubChem CID:	92304100
Reduced:	ON2C11H12 (1)
Stoich.:	AB2C11D12 (1)
Weight, g/mol:	400.029997
ΔH_f, kcal/mol:	2.86
Dipole, Da:	4.73
IP(EA), eV:	-10.18(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-2-cyano-3-[5-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]furan-2-yl]prop-2-enamide

Drug info:

PubChemData

Smile

CC[C@H](C#N)NC(=O)C1=CC=CC=C1

DOS

IR

Vibrations