Geometry & MOs

Info

ID:	345794
PubChem CID:	127270094
Reduced:	O3N6C18H20 (1)
Stoich.:	A3B6C18D20 (1)
Weight, g/mol:	339.169525
ΔH_f, kcal/mol:	-61.43
Dipole, Da:	3.0
IP(EA), eV:	-9.5(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-imidazol-1-ylpiperidin-1-yl)-(3-propan-2-yl-[1,2]oxazolo[5,4-b]pyridin-5-yl)methanone

Drug info:

PubChemData

Smile

CN1C2=C(C=C(C=N2)C(=O)N3CCC(CC3)N4C=CN=C4)C(=O)N(C1=O)C

DOS

IR

Vibrations