Geometry & MOs

Info

ID:	263253
PubChem CID:	103349584
Reduced:	S2N4C13H20 (1)
Stoich.:	A2B4C13D20 (1)
Weight, g/mol:	322.03806
ΔH_f, kcal/mol:	29.64
Dipole, Da:	4.65
IP(EA), eV:	-8.36(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-methyl-1,3-thiazol-2-yl)-5-N-[(3-methylthiophen-2-yl)methyl]-1,2-thiazole-3,5-diamine

Drug info:

PubChemData

Smile

CC1=CSC(=N1)C2=C(SN=C2N)NC(C)CC(C)C

DOS

IR

Vibrations