Geometry & MOs

Info

ID:	67023
PubChem CID:	46505718
Reduced:	OC6H7 (4)
Stoich.:	AB6C7 (4)
Weight, g/mol:	535.283492
ΔH_f, kcal/mol:	-120.55
Dipole, Da:	5.31
IP(EA), eV:	-8.28(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3E,5E)-1-benzyl-3,5-bis[(4-morpholin-4-ylphenyl)methylidene]piperidin-4-one

Drug info:

PubChemData

Smile

CC(C)CCOC1=C(C=C(C=C1)/C=C/2\CCC3=C(C2=O)C=CC(=C3)OC)OC

DOS

IR

Vibrations