Geometry & MOs

Info

ID:	56339
PubChem CID:	17425129
Reduced:	N3O4H21C24 (1)
Stoich.:	A3B4C21D24 (1)
Weight, g/mol:	309.185255
ΔH_f, kcal/mol:	-97.79
Dipole, Da:	5.17
IP(EA), eV:	-9.11(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(4-fluorophenyl)piperazin-1-yl]-N-(2-methoxyethyl)propanamide

Drug info:

PubChemData

Smile

CC(=O)C1=CC=CC=C1NC(=O)CN2C(=O)C(NC2=O)(C)C3=CC=CC4=CC=CC=C43

DOS

IR

Vibrations