Geometry & MOs

Info

ID:	30257
PubChem CID:	841051
Reduced:	NSC12H13 (1)
Stoich.:	ABC12D13 (1)
Weight, g/mol:	329.93238
ΔH_f, kcal/mol:	18.67
Dipole, Da:	0.42
IP(EA), eV:	-8.68(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-iodo-N-(1,3-thiazol-2-yl)benzamide

Drug info:

PubChemData

Smile

CC1=NC2=C(S1)C=CC3=C2CCCC3

DOS

IR

Vibrations