Geometry & MOs

Info

ID:	138440
PubChem CID:	52367320
Reduced:	F2O3N4H16C18 (1)
Stoich.:	A2B3C4D16E18 (1)
Weight, g/mol:	370.225643
ΔH_f, kcal/mol:	-38.48
Dipole, Da:	3.99
IP(EA), eV:	-9.29(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclohexyl-N-[4-[(3S)-3-ethyl-2,6-dioxopiperidin-3-yl]phenyl]propanamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1[N+](=O)[O-])CO/N=C(\C)/C2=NC3=CC=CC=C3N2C(F)F

DOS

IR

Vibrations