Geometry & MOs

Info

ID:	123603
PubChem CID:	50855312
Reduced:	N3O3H17C19 (1)
Stoich.:	A3B3C17D19 (1)
Weight, g/mol:	335.126991
ΔH_f, kcal/mol:	-13.92
Dipole, Da:	1.76
IP(EA), eV:	-8.15(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-N-[(E)-[1-(4-methoxyphenyl)pyrrol-3-yl]methylideneamino]benzamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)N2C=CC(=C2)/C=N/NC(=O)C3=CC=CC=C3O

DOS

IR

Vibrations