Geometry & MOs

Info

ID:	16738
PubChem CID:	476184
Reduced:	SN4C20H24 (1)
Stoich.:	AB4C20D24 (1)
Weight, g/mol:	352.172168
ΔH_f, kcal/mol:	70.29
Dipole, Da:	2.14
IP(EA), eV:	-8.4(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2-diethyl-1-(6-methyl-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)guanidine

Drug info:

PubChemData

Smile

CCN=C(NC1=CC=C(C=C1)C)N(CC)C2=NC3=C(S2)C=C(C=C3)C

DOS

IR

Vibrations