Geometry & MOs

Info

ID:	437179
PubChem CID:	135215485
Reduced:	S2O3N4C26H40 (1)
Stoich.:	A2B3C4D26E40 (1)
Weight, g/mol:	379.167811
ΔH_f, kcal/mol:	-91.33
Dipole, Da:	5.63
IP(EA), eV:	-8.96(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(=O)C1CN(C2=C1C=CC(=C2)S(=O)(=O)NC3(CC3)C)C4NNC(S4)(C)C5CCCCCCCC5

DOS

IR

Vibrations