Geometry & MOs

Info

ID:	385862
PubChem CID:	134980163
Reduced:	OF3H13C15 (1)
Stoich.:	AB3C13D15 (1)
Weight, g/mol:	286.076057
ΔH_f, kcal/mol:	-145.65
Dipole, Da:	4.18
IP(EA), eV:	-10.15(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (Z)-2-benzyl-3-(2-chlorophenyl)prop-2-enoate

Drug info:

PubChemData

Smile

C1[C@H]2C=C[C@@H]1[C@@H]([C@H]2C(=O)C3=CC=CC=C3)C(F)(F)F

DOS

IR

Vibrations