Geometry & MOs

Info

ID:	208705
PubChem CID:	80569082
Reduced:	SN2O3C15H16 (1)
Stoich.:	AB2C3D15E16 (1)
Weight, g/mol:	242.108899
ΔH_f, kcal/mol:	-62.09
Dipole, Da:	1.87
IP(EA), eV:	-9.02(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-methyl-2-(pentylamino)-1,3-thiazole-5-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CSC(=N1)N2CCOC3=CC=CC=C3C2

DOS

IR

Vibrations