Geometry & MOs

Info

ID:	351574
PubChem CID:	127280466
Reduced:	O3N5C21H27 (1)
Stoich.:	A3B5C21D27 (1)
Weight, g/mol:	371.19574
ΔH_f, kcal/mol:	-27.69
Dipole, Da:	6.6
IP(EA), eV:	-9.49(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(3,6-dimethyl-[1,2]oxazolo[5,4-b]pyridine-4-carbonyl)piperazin-1-yl]-2-pyrrolidin-1-ylethanone

Drug info:

PubChemData

Smile

CC1=NOC2=C1C(=CC(=N2)C3CC3)C(=O)N4CCN(CC4)C(=O)CN5CCCC5

DOS

IR

Vibrations