Geometry & MOs

Info

ID:	228252
PubChem CID:	87563749
Reduced:	N2H7C8 (2)
Stoich.:	A2B7C8 (2)
Weight, g/mol:	457.175004
ΔH_f, kcal/mol:	130.11
Dipole, Da:	2.44
IP(EA), eV:	-8.06(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-hydroxy-2-(oxolan-2-ylmethylcarbamoylamino)-6-[4-(2-pyridin-3-ylethynyl)phenyl]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

C#CC1=CC(=CC=C1)C2(C3=C(C=CC(=C3)N)NC=N2)N

DOS

IR

Vibrations