Geometry & MOs

Info

ID:	422918
PubChem CID:	135118612
Reduced:	SF2N2O2C18H18 (1)
Stoich.:	AB2C2D2E18F18 (1)
Weight, g/mol:	353.140927
ΔH_f, kcal/mol:	-134.07
Dipole, Da:	5.15
IP(EA), eV:	-9.06(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(2-ethyl-4-methyl-3-oxopiperazine-1-carbonyl)phenyl]-N-methylmethanesulfonamide

Drug info:

PubChemData

Smile

C1COC2(CCN(CC2)C(=O)NC3=C(C=CC(=C3)F)F)C4=C1SC=C4

DOS

IR

Vibrations