Geometry & MOs

Info

ID:	123610
PubChem CID:	50855584
Reduced:	NOH9C10 (2)
Stoich.:	ABC9D10 (2)
Weight, g/mol:	326.141913
ΔH_f, kcal/mol:	18.3
Dipole, Da:	6.98
IP(EA), eV:	-8.61(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(4-methoxyphenyl)pyrrol-3-yl]-N-naphthalen-2-ylmethanimine

Drug info:

PubChemData

Smile

CC(=O)C1=CC=C(C=C1)N=CC2=CN(C=C2)C3=CC=C(C=C3)OC

DOS

IR

Vibrations