Geometry & MOs

Info

ID:	156722
PubChem CID:	56371913
Reduced:	O2N5C26H27 (1)
Stoich.:	A2B5C26D27 (1)
Weight, g/mol:	430.08045
ΔH_f, kcal/mol:	15.64
Dipole, Da:	5.05
IP(EA), eV:	-8.68(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromo-4-fluorophenyl)-2-(1-ethylbenzimidazol-2-yl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2N=C1C3CCCN3C(=O)NC4=CN=C(C=C4)OC5=CC=C(C=C5)C

DOS

IR

Vibrations