Geometry & MOs

Info

ID:	148264
PubChem CID:	53787926
Reduced:	PN2F3O3C22H22 (1)
Stoich.:	AB2C3D3E22F22 (1)
Weight, g/mol:	208.029107
ΔH_f, kcal/mol:	-266.75
Dipole, Da:	7.37
IP(EA), eV:	-9.23(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-chloro-2-phenylethenyl) prop-2-enoate

Drug info:

PubChemData

Smile

CP(=O)(C)CCCOC(=O)C1=CC=CC=C1NC2=C(C=NC3=CC=CC=C32)C(F)(F)F

DOS

IR

Vibrations