Geometry & MOs

Info

ID:	435620
PubChem CID:	135191959
Reduced:	ON2F3C12H15 (1)
Stoich.:	AB2C3D12E15 (1)
Weight, g/mol:	237.100108
ΔH_f, kcal/mol:	-178.54
Dipole, Da:	4.73
IP(EA), eV:	-8.77(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-formamido-4-propoxybenzoate

Drug info:

PubChemData

Smile

CNC1=C(C=C(C=C1)C(F)(F)F)CCC(C=O)N

DOS

IR

Vibrations