Geometry & MOs

Info

ID:	263248
PubChem CID:	103349344
Reduced:	O2S2N3C12H21 (1)
Stoich.:	A2B2C3D12E21 (1)
Weight, g/mol:	294.097289
ΔH_f, kcal/mol:	-58.2
Dipole, Da:	6.37
IP(EA), eV:	-8.53(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-N-(cyclobutylmethyl)-5-N-methyl-4-(4-methyl-1,3-thiazol-2-yl)-1,2-thiazole-3,5-diamine

Drug info:

PubChemData

Smile

CCCCN(CC)C1=C(C(=NS1)N)S(=O)(=O)C2CC2

DOS

IR

Vibrations