Geometry & MOs

Info

ID:	166153
PubChem CID:	74642705
Reduced:	N2O5C25H32 (1)
Stoich.:	A2B5C25D32 (1)
Weight, g/mol:	491.162725
ΔH_f, kcal/mol:	-171.12
Dipole, Da:	5.94
IP(EA), eV:	-7.78(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(3-methylphenyl)piperazine-1-carbonyl]phenyl]-2-oxo-3,5-dihydrobenzimidazole-5-sulfonamide

Drug info:

PubChemData

Smile

CCCOC1=C(C=C(C=C1)NC(=O)C(C)NC(=O)C=CC2=CC=C(C=C2)OC)OCCC

DOS

IR

Vibrations