Geometry & MOs

Info

ID:	209546
PubChem CID:	80686924
Reduced:	NSO3C15H21 (1)
Stoich.:	ABC3D15E21 (1)
Weight, g/mol:	294.949318
ΔH_f, kcal/mol:	-113.94
Dipole, Da:	8.28
IP(EA), eV:	-9.62(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-2-(2,2,3,3,3-pentafluoropropoxy)-1,3-thiazole-5-carbaldehyde

Drug info:

PubChemData

Smile

CN(C1CCC(=O)CC1)S(=O)(=O)CCC2=CC=CC=C2

DOS

IR

Vibrations