Geometry & MOs

Info

ID:	177647
PubChem CID:	76208282
Reduced:	F2O2N3C11H13 (1)
Stoich.:	A2B2C3D11E13 (1)
Weight, g/mol:	263.061614
ΔH_f, kcal/mol:	-122.03
Dipole, Da:	3.79
IP(EA), eV:	-9.33(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(5-acetyl-3H-1,3-thiazol-2-ylidene)-2-ethoxycyclohexa-2,5-dien-1-one

Drug info:

PubChemData

Smile

CC(CC(=NO)N)NC(=O)C1=C(C(=CC=C1)F)F

DOS

IR

Vibrations