Geometry & MOs

Info

ID:	201328
PubChem CID:	79525400
Reduced:	ClOSN3C15H18 (1)
Stoich.:	ABCD3E15F18 (1)
Weight, g/mol:	367.93857
ΔH_f, kcal/mol:	-20.29
Dipole, Da:	7.64
IP(EA), eV:	-8.76(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-bromo-2-methoxyphenyl)-6-chloro-1,3-benzothiazol-2-amine

Drug info:

PubChemData

Smile

C1CCC(CC1)(C#N)NC(=O)CSC2=C(C=CC(=C2)Cl)N

DOS

IR

Vibrations