Geometry & MOs

Info

ID:	268885
PubChem CID:	103601754
Reduced:	SF2N2O2C11H12 (1)
Stoich.:	AB2C2D2E11F12 (1)
Weight, g/mol:	273.919296
ΔH_f, kcal/mol:	-147.12
Dipole, Da:	2.75
IP(EA), eV:	-9.48(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]acetonitrile

Drug info:

PubChemData

Smile

C1CN(CCN1C(=O)C2=CC=CS2)C(=O)C(F)F

DOS

IR

Vibrations