Geometry & MOs

Info

ID:	401870
PubChem CID:	135053135
Reduced:	NO3C27H27 (1)
Stoich.:	AB3C27D27 (1)
Weight, g/mol:	425.199094
ΔH_f, kcal/mol:	-49.93
Dipole, Da:	5.58
IP(EA), eV:	-8.98(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-ethoxy-6,8-diphenyl-2-piperidin-1-ylchromen-4-one

Drug info:

PubChemData

Smile

CCN(CC)C1=CC(=O)C2=CC(=C(C(=C2O1)C3=CC=CC=C3)OCC)C4=CC=CC=C4

DOS

IR

Vibrations