Geometry & MOs

Info

ID:	436573
PubChem CID:	135205581
Reduced:	ON4C14H16 (2)
Stoich.:	AB4C14D16 (2)
Weight, g/mol:	406.094705
ΔH_f, kcal/mol:	35.74
Dipole, Da:	7.86
IP(EA), eV:	-8.47(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-(1-methylcyclopropyl)-1-[(5-nitrofuran-2-yl)methyl]-2-oxobenzimidazole-5-sulfonamide

Drug info:

PubChemData

Smile

CC1(CC2=C(C1)N3CCN(C(=O)C3=C2)C4=NC=CC(=C4CO)C5=C6C(=NC=C5)NN=C6NC7CCNC7)C

DOS

IR

Vibrations