Geometry & MOs

Info

ID:	363876
PubChem CID:	127313533
Reduced:	N3O4C20H27 (1)
Stoich.:	A3B4C20D27 (1)
Weight, g/mol:	385.21139
ΔH_f, kcal/mol:	-132.03
Dipole, Da:	7.27
IP(EA), eV:	-8.77(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-3-ethyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide

Drug info:

PubChemData

Smile

C1CC(C1)C(=O)N2CCN(CC2)CCNC(=O)CC3=CC4=C(C=C3)OCO4

DOS

IR

Vibrations