Geometry & MOs

Info

ID:	77177
PubChem CID:	48425889
Reduced:	O3N4C17H20 (1)
Stoich.:	A3B4C17D20 (1)
Weight, g/mol:	310.169271
ΔH_f, kcal/mol:	-50.85
Dipole, Da:	2.92
IP(EA), eV:	-9.08(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-2-oxoethyl]-4-(4-fluorophenoxy)butanamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)C1=C(OC(=C1C#N)N2C=CC=C2)C

DOS

IR

Vibrations