Geometry & MOs

Info

ID:	267703
PubChem CID:	103585498
Reduced:	NF2O2C12H15 (1)
Stoich.:	AB2C2D12E15 (1)
Weight, g/mol:	239.087018
ΔH_f, kcal/mol:	-175.88
Dipole, Da:	4.0
IP(EA), eV:	-8.8(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyanomethyl)-2-(2,5-difluoro-4-methylanilino)acetamide

Drug info:

PubChemData

Smile

CCCC(C(=O)O)NC1=C(C=C(C(=C1)F)C)F

DOS

IR

Vibrations