Geometry & MOs

Info

ID:	263582
PubChem CID:	103379797
Reduced:	ClOSN4C12H13 (1)
Stoich.:	ABCD4E12F13 (1)
Weight, g/mol:	325.065176
ΔH_f, kcal/mol:	7.41
Dipole, Da:	5.96
IP(EA), eV:	-8.66(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-amino-5-[(3-chlorophenyl)methyl-methylamino]-1,2-thiazole-4-carboxylate

Drug info:

PubChemData

Smile

CN(CC1=CC(=CC=C1)Cl)C2=C(C(=NS2)N)C(=O)N

DOS

IR

Vibrations