Geometry & MOs

Info

ID:	89686
PubChem CID:	49963709
Reduced:	OSC14H16 (1)
Stoich.:	ABC14D16 (1)
Weight, g/mol:	255.071785
ΔH_f, kcal/mol:	-19.23
Dipole, Da:	2.31
IP(EA), eV:	-9.1(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-benzothiazol-2-yl-(3-methylphenyl)methanol

Drug info:

PubChemData

Smile

CCC1=CC=C(S1)C(C2=CC=CC(=C2)C)O

DOS

IR

Vibrations