Geometry & MOs

Info

ID:	36471
PubChem CID:	8007179
Reduced:	SN2O5C19H22 (1)
Stoich.:	AB2C5D19E22 (1)
Weight, g/mol:	350.120132
ΔH_f, kcal/mol:	-119.91
Dipole, Da:	3.76
IP(EA), eV:	-8.29(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-ethylbenzimidazol-1-yl)-N-(2-methyl-1,3-benzothiazol-6-yl)acetamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C2=NN([C@H](C2)C3=CC=CC=C3OC)S(=O)(=O)C)OC

DOS

IR

Vibrations