Geometry & MOs

Info

ID:	47147
PubChem CID:	10529978
Reduced:	N2O5H28C32 (1)
Stoich.:	A2B5C28D32 (1)
Weight, g/mol:	520.215078
ΔH_f, kcal/mol:	-116.29
Dipole, Da:	9.18
IP(EA), eV:	-8.77(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-methoxyazulen-1-yl)-N-[4-[4-[(3-methoxyazulen-1-yl)methylideneamino]phenyl]phenyl]methanimine

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC(=C2)C3=CC(=O)C4=CC=CC=C4O3)C(=O)NC5=CC=CC=C5)C)C

DOS

IR

Vibrations