Geometry & MOs

Info

ID:	364739
PubChem CID:	127316045
Reduced:	ON4C18H22 (1)
Stoich.:	AB4C18D22 (1)
Weight, g/mol:	340.164774
ΔH_f, kcal/mol:	5.46
Dipole, Da:	3.41
IP(EA), eV:	-9.04(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-ethyl-[1,2]oxazolo[5,4-b]pyridin-5-yl)-[4-(1H-imidazol-2-ylmethyl)piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CC2=C(C1)C=C(C=C2)C(=O)N3CCN(CC3)CC4=NC=CN4

DOS

IR

Vibrations