Geometry & MOs

Info

ID:	68829
PubChem CID:	46509171
Reduced:	N3O5H17C22 (1)
Stoich.:	A3B5C17D22 (1)
Weight, g/mol:	492.078967
ΔH_f, kcal/mol:	-110.4
Dipole, Da:	3.38
IP(EA), eV:	-8.76(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3-(1H-benzimidazol-2-yl)piperidine-1-carbonyl]-2,4-dichloro-N-cyclopropylbenzenesulfonamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)N(C2=O)CCC(=O)NC3=CC(=CC=C3)NC(=O)C4=CC=CO4

DOS

IR

Vibrations