Geometry & MOs

Info

ID:	208768
PubChem CID:	80582190
Reduced:	FN2O2H13C14 (1)
Stoich.:	AB2C2D13E14 (1)
Weight, g/mol:	225.184112
ΔH_f, kcal/mol:	-40.68
Dipole, Da:	2.21
IP(EA), eV:	-8.78(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-3-[2-(pentan-2-ylamino)ethyl]imidazol-2-one

Drug info:

PubChemData

Smile

CN1C=CN(C1=O)CC2=CC(=CC(=C2)F)C#CCO

DOS

IR

Vibrations