Geometry & MOs

Info

ID:	38091
PubChem CID:	8026946
Reduced:	SN3O3C18H23 (1)
Stoich.:	AB3C3D18E23 (1)
Weight, g/mol:	318.060903
ΔH_f, kcal/mol:	-94.0
Dipole, Da:	6.27
IP(EA), eV:	-8.85(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(1-methylbenzimidazol-2-yl)sulfanylmethyl]-1,3-thiazol-2-yl]acetamide

Drug info:

PubChemData

Smile

CCCC1=CC(=O)N=C(N1)S[C@@H](C)C(=O)NCC2=CC=C(C=C2)OC

DOS

IR

Vibrations