Geometry & MOs

Info

ID:	130626
PubChem CID:	51091805
Reduced:	OF3N6C14H17 (1)
Stoich.:	AB3C6D14E17 (1)
Weight, g/mol:	330.137971
ΔH_f, kcal/mol:	-117.52
Dipole, Da:	5.32
IP(EA), eV:	-9.41(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-acetamido-2-fluoro-N-[[3-(methoxymethyl)phenyl]methyl]benzamide

Drug info:

PubChemData

Smile

CN(CCCNC(=O)C1=CC(=NC=C1)N2C=NC=N2)CC(F)(F)F

DOS

IR

Vibrations