Geometry & MOs

Info

ID:	71818
PubChem CID:	48415502
Reduced:	OSN5C22H23 (1)
Stoich.:	ABC5D22E23 (1)
Weight, g/mol:	386.141262
ΔH_f, kcal/mol:	61.31
Dipole, Da:	6.86
IP(EA), eV:	-8.57(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-N-methyl-3-(methylsulfamoyl)benzamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)C3=CN=C(N3C4=CC=CC=C4)SC

DOS

IR

Vibrations