Geometry & MOs

Info

ID:	263566
PubChem CID:	103378934
Reduced:	SO2N3C13H19 (1)
Stoich.:	AB2C3D13E19 (1)
Weight, g/mol:	310.092204
ΔH_f, kcal/mol:	-33.27
Dipole, Da:	6.35
IP(EA), eV:	-8.49(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC(=O)C1=C(SN=C1N)NCC(C2CC2)C3CC3

DOS

IR

Vibrations