Geometry & MOs

Info

ID:	299853
PubChem CID:	117695950
Reduced:	NO2C6H11 (2)
Stoich.:	AB2C6D11 (2)
Weight, g/mol:	415.144453
ΔH_f, kcal/mol:	-142.35
Dipole, Da:	5.04
IP(EA), eV:	-9.27(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[[4-(4-fluorophenyl)pyridin-2-yl]-pyrazin-2-ylamino]methyl]-N-hydroxybenzamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N(CC(=O)N(C)OC)C1CC1

DOS

IR

Vibrations