Geometry & MOs

Info

ID:	449705
PubChem CID:	135300794
Reduced:	NO5C18H20 (2)
Stoich.:	AB5C18D20 (2)
Weight, g/mol:	240.126263
ΔH_f, kcal/mol:	-366.43
Dipole, Da:	6.51
IP(EA), eV:	-8.21(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2E)-2-[5-(ethylamino)-1H-pyridin-2-ylidene]ethylidene]cyclohexa-2,5-dien-1-one

Drug info:

PubChemData

Smile

CC(C)C1=CC(=C(C=C1C(=O)OCCOC(=O)C(=C)C)C(=O)OCCOC(=O)C(C)C)C(=O)NC2=CC=C(C=C2)OC3=CC=C(C=C3)N

DOS

IR

Vibrations