Geometry & MOs

Info

ID:	323305
PubChem CID:	126674079
Reduced:	OF2N5C23H23 (1)
Stoich.:	AB2C5D23E23 (1)
Weight, g/mol:	234.089209
ΔH_f, kcal/mol:	-41.46
Dipole, Da:	8.6
IP(EA), eV:	-9.02(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-bis(prop-2-enoxy)benzoic acid

Drug info:

PubChemData

Smile

CC(C1=C2C=CC=CC2=NN1)N3C=C(C4=C3C=CC=C4F)C(=O)NC5CCNC[C@@H]5F

DOS

IR

Vibrations