Geometry & MOs

Info

ID:	333132
PubChem CID:	127251680
Reduced:	FO2N5C25H28 (1)
Stoich.:	AB2C5D25E28 (1)
Weight, g/mol:	421.21139
ΔH_f, kcal/mol:	-44.63
Dipole, Da:	3.84
IP(EA), eV:	-8.85(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=CC(=N1)C2CN(CCO2)C(=O)CN(C)CC3=CC=CC=C3F)NC4=CC=CC=N4

DOS

IR

Vibrations