Geometry & MOs

Info

ID:	323663
PubChem CID:	126675679
Reduced:	N8H20C21 (1)
Stoich.:	A8B20C21 (1)
Weight, g/mol:	518.173625
ΔH_f, kcal/mol:	171.88
Dipole, Da:	4.34
IP(EA), eV:	-8.23(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[(1-cyanocyclopropyl)carbamoyl]cyclohexyl]-6-[2-(2-oxoimidazolidin-1-yl)-1,3-thiazol-4-yl]-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC=NC(=C1)C2=CC=CC(=C2)CN3C=C(C=N3)CC4=CC(=NC5=C4NNN5)N

DOS

IR

Vibrations