Geometry & MOs

Info

ID:	32573
PubChem CID:	7845775
Reduced:	SN3O4H19C21 (1)
Stoich.:	AB3C4D19E21 (1)
Weight, g/mol:	368.155849
ΔH_f, kcal/mol:	-87.03
Dipole, Da:	7.01
IP(EA), eV:	-8.76(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(2,5-dimethylphenyl)methylsulfanyl]-1-ethylbenzimidazole-5-carboxylate

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCN3C(=O)C4=CC=CC=C4C3=O

DOS

IR

Vibrations