Geometry & MOs

Info

ID:	123638
PubChem CID:	50857554
Reduced:	ON4H20C23 (1)
Stoich.:	AB4C20D23 (1)
Weight, g/mol:	275.142248
ΔH_f, kcal/mol:	96.67
Dipole, Da:	8.38
IP(EA), eV:	-8.58(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(Z)-(5-methyl-1-phenylpyrrol-3-yl)methylideneamino]aniline

Drug info:

PubChemData

Smile

CC1=CC(=CN1C2=CC=CC=C2)/C=N/NC(=O)C3=CC(=CC=C3)N4C=CC=C4

DOS

IR

Vibrations