Geometry & MOs

Info

ID:	332978
PubChem CID:	127251402
Reduced:	FO2N4C24H27 (1)
Stoich.:	AB2C4D24E27 (1)
Weight, g/mol:	449.206304
ΔH_f, kcal/mol:	-53.65
Dipole, Da:	5.06
IP(EA), eV:	-9.02(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2-[4-(2-ethyl-4-methyl-1,3-oxazole-5-carbonyl)morpholin-2-yl]-6-methylpyridin-4-yl]-N-methylpyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=N1)C2CN(CCO2)C(=O)C(C)(C)C3=CC(=CC=C3)F)C4=CN(N=C4)C

DOS

IR

Vibrations