Geometry & MOs

Info

ID:	414008
PubChem CID:	135086961
Reduced:	OCl2H10C15 (1)
Stoich.:	AB2C10D15 (1)
Weight, g/mol:	419.257277
ΔH_f, kcal/mol:	28.92
Dipole, Da:	3.37
IP(EA), eV:	-9.5(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(E)-1-morpholin-4-ylbutylideneamino]-1-(4-prop-1-en-2-ylcyclohexen-1-yl)indole-3-carbaldehyde

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C#CC(C2=C(C(=CC=C2)Cl)Cl)O

DOS

IR

Vibrations