Geometry & MOs

Info

ID:	42377
PubChem CID:	8149490
Reduced:	N4O5C21H28 (1)
Stoich.:	A4B5C21D28 (1)
Weight, g/mol:	341.190341
ΔH_f, kcal/mol:	-191.04
Dipole, Da:	7.37
IP(EA), eV:	-9.35(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(2-fluorophenyl)-2-(4-piperidin-1-ylanilino)propanamide

Drug info:

PubChemData

Smile

CC(C)CN1C(=C(C(=O)NC1=O)[C@H](C2=CC=C(C=C2)C(=O)OC)N3CCOCC3)N

DOS

IR

Vibrations