Geometry & MOs

Info

ID:	351564
PubChem CID:	127280456
Reduced:	O2N4C21H26 (1)
Stoich.:	A2B4C21D26 (1)
Weight, g/mol:	385.21139
ΔH_f, kcal/mol:	-44.56
Dipole, Da:	7.6
IP(EA), eV:	-9.04(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(3-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine-5-carbonyl)piperazin-1-yl]-2-pyrrolidin-1-ylethanone

Drug info:

PubChemData

Smile

C1CCN(C1)CC(=O)N2CCN(CC2)C(=O)CC3=CC=CC4=C3N=CC=C4

DOS

IR

Vibrations