Geometry & MOs

Info

ID:	27277
PubChem CID:	820183
Reduced:	OSN2C16H16 (1)
Stoich.:	ABC2D16E16 (1)
Weight, g/mol:	284.098334
ΔH_f, kcal/mol:	24.31
Dipole, Da:	3.57
IP(EA), eV:	-8.5(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-2-(2-methylimino-1,3-benzothiazol-3-yl)-1-phenylethanol

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2SC1=NC[C@@H](C3=CC=CC=C3)O

DOS

IR

Vibrations