Geometry & MOs

Info

ID:	69151
PubChem CID:	46525582
Reduced:	SO3N4H22C25 (1)
Stoich.:	AB3C4D22E25 (1)
Weight, g/mol:	382.146347
ΔH_f, kcal/mol:	-6.76
Dipole, Da:	4.36
IP(EA), eV:	-8.82(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1H-benzimidazol-2-ylsulfanylmethyl)-N'-(2-methylbutanoyl)benzohydrazide

Drug info:

PubChemData

Smile

C1C(COC2=CC=CC=C21)C(=O)NNC(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5N4

DOS

IR

Vibrations