Geometry & MOs

Info

ID:	313991
PubChem CID:	126619434
Reduced:	O2S2N3C6H7 (1)
Stoich.:	A2B2C3D6E7 (1)
Weight, g/mol:	318.097289
ΔH_f, kcal/mol:	-45.17
Dipole, Da:	2.21
IP(EA), eV:	-9.21(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-amino-1,3-thiazol-4-yl)-4-(2-ethylphenyl)-4-methyl-5H-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

C1=C(SC(=N1)NC(=S)N)CC(=O)O

DOS

IR

Vibrations