Geometry & MOs

Info

ID:	297753
PubChem CID:	117629197
Reduced:	O2F3N5H16C19 (1)
Stoich.:	A2B3C5D16E19 (1)
Weight, g/mol:	242.057909
ΔH_f, kcal/mol:	-148.89
Dipole, Da:	2.75
IP(EA), eV:	-9.36(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethenylnaphthalene-1,3-dicarboxylic acid

Drug info:

PubChemData

Smile

CC(C(=O)N)NC1=NC(=NC=C1)C2=CC=C(C=C2)OC3=NC=C(C=C3)C(F)(F)F

DOS

IR

Vibrations