Geometry & MOs

Info

ID:	203785
PubChem CID:	79869620
Reduced:	O2F3N3C12H16 (1)
Stoich.:	A2B3C3D12E16 (1)
Weight, g/mol:	269.126323
ΔH_f, kcal/mol:	-228.54
Dipole, Da:	5.08
IP(EA), eV:	-9.35(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[6-(hydroxymethyl)-4-oxopyran-3-yl]oxy-N-(3-methylbutan-2-yl)acetamide

Drug info:

PubChemData

Smile

CC(C)N(CCO)C1=C(C=CC(=N1)C(F)(F)F)C(=O)N

DOS

IR

Vibrations