Geometry & MOs

Info

ID:	148355
PubChem CID:	53788017
Reduced:	FON3C19H22 (1)
Stoich.:	ABC3D19E22 (1)
Weight, g/mol:	358.097187
ΔH_f, kcal/mol:	-24.67
Dipole, Da:	5.38
IP(EA), eV:	-9.05(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloroprop-2-enyl 3-methyl-4-(4-phenoxyphenoxy)but-2-enoate

Drug info:

PubChemData

Smile

C[C@H](CCN1CC(=O)NC2=CC=CC=C2C1C3=CC=CC=C3F)N

DOS

IR

Vibrations