Geometry & MOs

Info

ID:	209738
PubChem CID:	80710878
Reduced:	FNOC18H20 (1)
Stoich.:	ABCD18E20 (1)
Weight, g/mol:	231.08079
ΔH_f, kcal/mol:	-63.35
Dipole, Da:	5.0
IP(EA), eV:	-9.14(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-bis(cyanomethyl)-2-fluoro-3-methylbenzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(C)N(C)C(=O)C2=CC=CC(=C2F)C

DOS

IR

Vibrations