Geometry & MOs

Info

ID:	156838
PubChem CID:	56394651
Reduced:	ClO2F3N3C19H25 (1)
Stoich.:	AB2C3D3E19F25 (1)
Weight, g/mol:	463.247107
ΔH_f, kcal/mol:	-250.37
Dipole, Da:	7.21
IP(EA), eV:	-9.15(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2-methoxyphenyl)-1-(4-methylphenyl)-5-(4-propanoylpiperazine-1-carbonyl)piperidin-2-one

Drug info:

PubChemData

Smile

CCC(=O)N1CCN(CC1)C(=O)[C@H](C(C)C)NC2=C(C=C(C=C2)C(F)(F)F)Cl

DOS

IR

Vibrations