Geometry & MOs

Info

ID:	356590
PubChem CID:	127291816
Reduced:	O3N4C22H28 (1)
Stoich.:	A3B4C22D28 (1)
Weight, g/mol:	368.184841
ΔH_f, kcal/mol:	-79.44
Dipole, Da:	3.03
IP(EA), eV:	-8.86(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-4-[4-[(5-phenyl-1,3-oxazol-2-yl)methyl]piperazine-1-carbonyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

C1CCC(=O)N(CC1)CC(=O)N2CCN(CC2)CC3=NC=C(O3)C4=CC=CC=C4

DOS

IR

Vibrations