Geometry & MOs

Info

ID:	84027
PubChem CID:	49863428
Reduced:	SN3C9H11 (1)
Stoich.:	AB3C9D11 (1)
Weight, g/mol:	221.098669
ΔH_f, kcal/mol:	44.95
Dipole, Da:	2.81
IP(EA), eV:	-8.02(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N,2-N-diethyl-1,3-benzothiazole-2,6-diamine

Drug info:

PubChemData

Smile

CN(C)C1=NC2=C(S1)C=C(C=C2)N

DOS

IR

Vibrations