Geometry & MOs

Info

ID:	292108
PubChem CID:	114452176
Reduced:	FNCl2H14C15 (1)
Stoich.:	ABC2D14E15 (1)
Weight, g/mol:	290.062219
ΔH_f, kcal/mol:	-26.64
Dipole, Da:	3.53
IP(EA), eV:	-9.41(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chloro-5-fluorophenyl)-2-(3-methoxyanilino)acetonitrile

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)Cl)NCC2=CC(=CC(=C2)Cl)F

DOS

IR

Vibrations