Geometry & MOs

Info

ID:	195734
PubChem CID:	78729008
Reduced:	ClF2N2O4H11C15 (1)
Stoich.:	AB2C2D4E11F15 (1)
Weight, g/mol:	277.038651
ΔH_f, kcal/mol:	-139.96
Dipole, Da:	6.67
IP(EA), eV:	-9.76(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-fluoro-2-nitrophenyl) 3-(furan-2-yl)prop-2-enoate

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC(=C(C=C1)F)[N+](=O)[O-])OC2=CC(=C(C=C2)F)Cl

DOS

IR

Vibrations