Geometry & MOs

Info

ID:	81498
PubChem CID:	49854793
Reduced:	FO3N4H21C23 (1)
Stoich.:	AB3C4D21E23 (1)
Weight, g/mol:	404.159689
ΔH_f, kcal/mol:	-40.64
Dipole, Da:	7.75
IP(EA), eV:	-8.52(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-hydroxy-4-[[1-(2-methoxyethyl)-5-pyrimidin-5-ylbenzimidazol-2-yl]amino]benzamide

Drug info:

PubChemData

Smile

COCCN1C2=C(C=C(C=C2)C3=CC(=CC=C3)F)N=C1NC4=CC=C(C=C4)C(=O)NO

DOS

IR

Vibrations