Geometry & MOs

Info

ID:	28664
PubChem CID:	828844
Reduced:	SO3N4C12H14 (1)
Stoich.:	AB3C4D12E14 (1)
Weight, g/mol:	313.099731
ΔH_f, kcal/mol:	-45.6
Dipole, Da:	6.5
IP(EA), eV:	-9.2(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-amino-1,3-thiazol-4-yl)-N-[(2-methyl-1H-indol-3-yl)methylideneamino]acetamide

Drug info:

PubChemData

Smile

CC[C@@H](C)OC(=O)N1C=CC(=N1)C(=O)NC2=NC=CS2

DOS

IR

Vibrations