Geometry & MOs

Info

ID:	153576
PubChem CID:	56312829
Reduced:	F3N3O4C21H30 (1)
Stoich.:	A3B3C4D21E30 (1)
Weight, g/mol:	384.252526
ΔH_f, kcal/mol:	-315.7
Dipole, Da:	3.27
IP(EA), eV:	-8.87(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(4-benzylpiperazin-1-yl)propyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)propanamide

Drug info:

PubChemData

Smile

CCNC(=O)CN1CCCN(CC1)C(=O)CCC2=CC(=C(C=C2)OCC(F)(F)F)OC

DOS

IR

Vibrations