Geometry & MOs

Info

ID:	138242
PubChem CID:	52332895
Reduced:	FN4O4C18H19 (1)
Stoich.:	AB4C4D18E19 (1)
Weight, g/mol:	367.190734
ΔH_f, kcal/mol:	-100.52
Dipole, Da:	6.3
IP(EA), eV:	-9.73(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-[[(2S)-1-(4-fluorophenoxy)propan-2-yl]carbamoylamino]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

C[C@H](C1=CC(=CC=C1)[N+](=O)[O-])NC(=O)NCCNC(=O)C2=CC=CC=C2F

DOS

IR

Vibrations