Geometry & MOs

Info

ID:	313787
PubChem CID:	126617716
Reduced:	O3N5H17C19 (1)
Stoich.:	A3B5C17D19 (1)
Weight, g/mol:	410.104876
ΔH_f, kcal/mol:	6.27
Dipole, Da:	2.44
IP(EA), eV:	-8.76(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[(6-methoxyimidazo[2,1-b][1,3]benzothiazole-2-carbonyl)amino]phenyl]methyl-methylcarbamic acid

Drug info:

PubChemData

Smile

COCCOC1=NC=C(C=C1)NC(=O)C2=NC3=NC4=CC=CC=C4N3C=C2

DOS

IR

Vibrations