Geometry & MOs

Info

ID:	8457
PubChem CID:	77901
Reduced:	OSN2C11H12 (1)
Stoich.:	ABC2D11E12 (1)
Weight, g/mol:	220.067034
ΔH_f, kcal/mol:	6.55
Dipole, Da:	1.12
IP(EA), eV:	-8.77(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1,3-benzothiazol-2-yl)morpholine

Drug info:

PubChemData

Smile

C1COCCN1C2=NC3=CC=CC=C3S2

DOS

IR

Vibrations