Geometry & MOs

Info

ID:	240150
PubChem CID:	93576384
Reduced:	ClO3N4C23H25 (1)
Stoich.:	AB3C4D23E25 (1)
Weight, g/mol:	440.161518
ΔH_f, kcal/mol:	-76.37
Dipole, Da:	3.25
IP(EA), eV:	-9.22(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[2-[1-[2-oxo-2-[[(2R)-oxolan-2-yl]methylamino]ethyl]benzimidazol-2-yl]ethyl]benzamide

Drug info:

PubChemData

Smile

C1C[C@H](OC1)CNC(=O)CN2C3=CC=CC=C3N=C2CCNC(=O)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations