Geometry & MOs

Info

ID:	70983
PubChem CID:	48414142
Reduced:	SO3N4C17H24 (1)
Stoich.:	AB3C4D17E24 (1)
Weight, g/mol:	418.17871
ΔH_f, kcal/mol:	-89.84
Dipole, Da:	2.23
IP(EA), eV:	-9.55(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-(dimethylsulfamoyl)-1-ethylbenzimidazol-2-yl]-N-[(5-methyl-1H-pyrazol-4-yl)methyl]propanamide

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)NCC2=C(NN=C2)C)C

DOS

IR

Vibrations