Geometry & MOs

Info

ID:	232077
PubChem CID:	87575395
Reduced:	FO2N3H20C21 (1)
Stoich.:	AB2C3D20E21 (1)
Weight, g/mol:	159.953891
ΔH_f, kcal/mol:	-48.37
Dipole, Da:	6.6
IP(EA), eV:	-9.7(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

fluoro 2-chloro-3,3-difluoroprop-2-enoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N(CCC1=CC=C(C=C1)C2=CC(=C(C=C2)C#N)F)C#N

DOS

IR

Vibrations