Geometry & MOs

Info

ID:	351506
PubChem CID:	127280394
Reduced:	O3N5C19H23 (1)
Stoich.:	A3B5C19D23 (1)
Weight, g/mol:	368.184841
ΔH_f, kcal/mol:	-24.52
Dipole, Da:	5.29
IP(EA), eV:	-9.33(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[4-(1,3-oxazol-5-yl)benzoyl]piperazin-1-yl]-2-pyrrolidin-1-ylethanone

Drug info:

PubChemData

Smile

C1CCN(C1)CC(=O)N2CCN(CC2)C(=O)C3=NOC(=C3)C4=CC=NC=C4

DOS

IR

Vibrations