Geometry & MOs

Info

ID:	200461
PubChem CID:	79391121
Reduced:	SN6C10H10 (1)
Stoich.:	AB6C10D10 (1)
Weight, g/mol:	254.01837
ΔH_f, kcal/mol:	118.83
Dipole, Da:	8.87
IP(EA), eV:	-8.85(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

thiophen-2-ylmethyl 5-amino-3-methyl-1,2-thiazole-4-carboxylate

Drug info:

PubChemData

Smile

CC1=NN2C(=NN=C2C3=C(SN=C3C)N)C=C1

DOS

IR

Vibrations