Geometry & MOs

Info

ID:	85765
PubChem CID:	49878900
Reduced:	ON2C16H20 (1)
Stoich.:	AB2C16D20 (1)
Weight, g/mol:	392.130697
ΔH_f, kcal/mol:	-24.59
Dipole, Da:	2.52
IP(EA), eV:	-8.34(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(N-methylanilino)propyl]-4-oxo-[1,3]thiazino[3,2-a]benzimidazole-2-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)(C2CCN3C2=NC4=CC=CC=C4C3)O

DOS

IR

Vibrations