Geometry & MOs

Info

ID:	123623
PubChem CID:	50856621
Reduced:	OF2N2H16C19 (1)
Stoich.:	AB2C2D16E19 (1)
Weight, g/mol:	348.147393
ΔH_f, kcal/mol:	-40.41
Dipole, Da:	4.49
IP(EA), eV:	-8.5(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[1-(4-methoxyphenyl)-5-methylpyrrol-2-yl]methylideneamino]-4-methylbenzoic acid

Drug info:

PubChemData

Smile

CC1=CC=C(N1C2=CC=C(C=C2)OC)C=NC3=C(C=C(C=C3)F)F

DOS

IR

Vibrations