Geometry & MOs

Info

ID:	436564
PubChem CID:	135205440
Reduced:	ClF3O5N6H24C28 (1)
Stoich.:	AB3C5D6E24F28 (1)
Weight, g/mol:	391.066048
ΔH_f, kcal/mol:	-198.15
Dipole, Da:	5.35
IP(EA), eV:	-8.51(-1.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-formylthiophen-2-yl)-1-methyl-N-(1-methylcyclopropyl)-2-oxobenzimidazole-5-sulfonamide

Drug info:

PubChemData

Smile

CN1C=C2C=C(C=CC2=N1)NC(=O)C(CCOC)N3C=C(C(=CC3=O)C4=C(C=CC(=C4)Cl)C5=NN=C(O5)C(F)(F)F)OC

DOS

IR

Vibrations