Geometry & MOs

Info

ID:	161693
PubChem CID:	57392344
Reduced:	O2N3H17C19 (1)
Stoich.:	A2B3C17D19 (1)
Weight, g/mol:	439.108103
ΔH_f, kcal/mol:	-15.15
Dipole, Da:	2.56
IP(EA), eV:	-8.84(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-N-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)piperidin-3-yl]-1H-benzimidazole-2-sulfonamide

Drug info:

PubChemData

Smile

C1CNC(=O)C2=CC3=C(N2C1)C=C(C=C3)C(=O)NC4=CC=CC=C4

DOS

IR

Vibrations