Geometry & MOs

Info

ID:	265661
PubChem CID:	103537605
Reduced:	NO3C15H19 (1)
Stoich.:	AB3C15D19 (1)
Weight, g/mol:	279.127072
ΔH_f, kcal/mol:	-92.48
Dipole, Da:	8.73
IP(EA), eV:	-9.23(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-[2-fluoro-5-[(3-methoxypyrrolidin-1-yl)methyl]phenyl]prop-2-enoic acid

Drug info:

PubChemData

Smile

COC1CCN(C1)CC2=CC(=CC=C2)/C=C/C(=O)O

DOS

IR

Vibrations