Geometry & MOs

Info

ID:	263558
PubChem CID:	103378350
Reduced:	SO2N3C11H19 (1)
Stoich.:	AB2C3D11E19 (1)
Weight, g/mol:	257.083413
ΔH_f, kcal/mol:	-84.84
Dipole, Da:	6.5
IP(EA), eV:	-8.5(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-amino-5-(oxolan-3-ylmethylamino)-1,2-thiazole-4-carboxylate

Drug info:

PubChemData

Smile

CC(C)CCCNC1=C(C(=NS1)N)C(=O)OC

DOS

IR

Vibrations