Geometry & MOs

Info

ID:	329762
PubChem CID:	127246629
Reduced:	ON6C18H20 (1)
Stoich.:	AB6C18D20 (1)
Weight, g/mol:	337.153875
ΔH_f, kcal/mol:	51.16
Dipole, Da:	8.81
IP(EA), eV:	-9.07(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,6-dimethyl-[1,2]oxazolo[5,4-b]pyridin-4-yl)-[3-(4-methylpyrimidin-2-yl)pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=NC(=NC=C1)C2CCN(C2)C(=O)C3=NN4C(=CC(=NC4=C3)C)C

DOS

IR

Vibrations