Geometry & MOs

Info

ID:	338459
PubChem CID:	127259151
Reduced:	SO2N4C6H10 (1)
Stoich.:	AB2C4D6E10 (1)
Weight, g/mol:	251.072848
ΔH_f, kcal/mol:	-41.22
Dipole, Da:	2.71
IP(EA), eV:	-8.61(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(6-amino-1H-benzimidazol-2-yl)sulfanyl]ethyl acetate

Drug info:

PubChemData

Smile

CC(=O)OCCSC1=NNC(=N1)N

DOS

IR

Vibrations