Geometry & MOs

Info

ID:	26948
PubChem CID:	804655
Reduced:	ClON2H15C19 (1)
Stoich.:	ABC2D15E19 (1)
Weight, g/mol:	307.120843
ΔH_f, kcal/mol:	38.79
Dipole, Da:	4.03
IP(EA), eV:	-9.4(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1,2-dimethyl-4-(naphthalen-1-ylmethylidene)-5-oxopyrrole-3-carboxylate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CN(C2=CC=CC=N2)C(=O)C3=CC(=CC=C3)Cl

DOS

IR

Vibrations