Geometry & MOs

Info

ID:	79982
PubChem CID:	49831970
Reduced:	O2F4H12C13 (1)
Stoich.:	A2B4C12D13 (1)
Weight, g/mol:	416.070543
ΔH_f, kcal/mol:	-252.09
Dipole, Da:	1.88
IP(EA), eV:	-10.39(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-[2,3,5,6-tetrafluoro-4-[(E)-3-[(2-methylpropan-2-yl)oxy]-3-oxoprop-1-enyl]phenyl]thiophene-2-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)/C=C/C1=C(C(=CC(=C1F)F)F)F

DOS

IR

Vibrations