Geometry & MOs

Info

ID:	331693
PubChem CID:	127249776
Reduced:	SO3N6C19H22 (1)
Stoich.:	AB3C6D19E22 (1)
Weight, g/mol:	383.159354
ΔH_f, kcal/mol:	-22.94
Dipole, Da:	2.28
IP(EA), eV:	-8.89(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,4-dimethyl-1,3-oxazol-5-yl)-[2-[6-[(5-methyl-1,2-oxazol-3-yl)amino]pyridin-2-yl]morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

CCC1=NN=C(S1)NC2=CC=CC(=N2)C3CN(CCO3)C(=O)C4=C(N=C(O4)C)C

DOS

IR

Vibrations