Geometry & MOs

Info

ID:	351523
PubChem CID:	127280411
Reduced:	O2N5C21H31 (1)
Stoich.:	A2B5C21D31 (1)
Weight, g/mol:	369.18009
ΔH_f, kcal/mol:	-62.85
Dipole, Da:	6.71
IP(EA), eV:	-8.65(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(5-pyridin-3-yl-1,2-oxazole-3-carbonyl)piperazin-1-yl]-2-pyrrolidin-1-ylethanone

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=C(C=CC=N2)C(=O)N3CCN(CC3)C(=O)CN4CCCC4

DOS

IR

Vibrations