Geometry & MOs

Info

ID:	372719
PubChem CID:	131303177
Reduced:	SN2C13H18 (1)
Stoich.:	AB2C13D18 (1)
Weight, g/mol:	234.11907
ΔH_f, kcal/mol:	7.64
Dipole, Da:	2.11
IP(EA), eV:	-8.89(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,4-dimethyl-1,3-benzothiazol-5-yl)-2-methylpropan-2-amine

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1CC(C)(C)N)N=C(S2)C

DOS

IR

Vibrations