Geometry & MOs

Info

ID:	126161
PubChem CID:	50953978
Reduced:	SN3O3H13C14 (1)
Stoich.:	AB3C3D13E14 (1)
Weight, g/mol:	386.096123
ΔH_f, kcal/mol:	-50.38
Dipole, Da:	3.43
IP(EA), eV:	-9.89(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(6-fluoro-1H-benzimidazol-2-yl)methyl]-N-methyl-5-(1H-1,2,4-triazol-5-ylsulfanylmethyl)furan-2-carboxamide

Drug info:

PubChemData

Smile

C1C2=C(C=CC=N2)C(=O)N1CC3=CC=C(C=C3)S(=O)(=O)N

DOS

IR

Vibrations