Geometry & MOs

Info

ID:	206027
PubChem CID:	80190892
Reduced:	ON3C12H23 (1)
Stoich.:	AB3C12D23 (1)
Weight, g/mol:	278.143056
ΔH_f, kcal/mol:	-50.38
Dipole, Da:	3.02
IP(EA), eV:	-9.0(1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-fluoro-5-methylbenzoyl)-1,3,3-trimethylpiperazin-2-one

Drug info:

PubChemData

Smile

CC1(CCN(C1)CC(C2CC2)(C(=O)N)N)C

DOS

IR

Vibrations