Geometry & MOs

Info

ID:	265435
PubChem CID:	103520563
Reduced:	IO2N3H10C11 (1)
Stoich.:	AB2C3D10E11 (1)
Weight, g/mol:	276.127406
ΔH_f, kcal/mol:	2.76
Dipole, Da:	3.77
IP(EA), eV:	-9.58(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-cyano-2-fluorophenyl)methyl]-2-(1-methoxycyclobutyl)acetamide

Drug info:

PubChemData

Smile

CN1C(=CC=N1)NC(=O)C2=C(C=CC(=C2)I)O

DOS

IR

Vibrations