Geometry & MOs

Info

ID:	276630
PubChem CID:	103824530
Reduced:	O2N3C14H23 (1)
Stoich.:	A2B3C14D23 (1)
Weight, g/mol:	315.90727
ΔH_f, kcal/mol:	-93.94
Dipole, Da:	4.49
IP(EA), eV:	-9.83(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromo-3-chlorophenyl)-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1(CCCCC1)C#N)C(=O)NC

DOS

IR

Vibrations