Geometry & MOs

Info

ID:	80865
PubChem CID:	49846692
Reduced:	N3O5H13C15 (1)
Stoich.:	A3B5C13D15 (1)
Weight, g/mol:	324.072177
ΔH_f, kcal/mol:	-37.28
Dipole, Da:	8.04
IP(EA), eV:	-9.36(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-hydroxy-3-[2-oxo-1-[(3,4,5-trifluorophenyl)methyl]pyridin-3-yl]prop-2-enamide

Drug info:

PubChemData

Smile

C1=CN(C(=O)C(=C1)/C=C/C(=O)NO)CC2=CC=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations