Geometry & MOs

Info

ID:	395414
PubChem CID:	135025398
Reduced:	NC12H15 (2)
Stoich.:	AB12C15 (2)
Weight, g/mol:	294.046299
ΔH_f, kcal/mol:	36.77
Dipole, Da:	1.49
IP(EA), eV:	-8.38(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-anilinopyrano[2,3-g][1,3]benzothiazol-7-one

Drug info:

PubChemData

Smile

CCC1(CCCN(C1)CC2=CC=CC=C2)CCC3=CC4=CC=CC=C4N3

DOS

IR

Vibrations