Geometry & MOs

Info

ID:	171302
PubChem CID:	75356658
Reduced:	O3N5C22H23 (1)
Stoich.:	A3B5C22D23 (1)
Weight, g/mol:	434.186652
ΔH_f, kcal/mol:	-78.25
Dipole, Da:	3.89
IP(EA), eV:	-8.49(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(1H-benzimidazol-2-yl)-2-methylpropyl]-1-(4-fluoro-1H-indazol-3-yl)-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)CC1=NC2=C(N1)C=C(C=C2)NC(=O)CC3C(=O)NC4=CC=CC=C4C(=O)N3

DOS

IR

Vibrations