Geometry & MOs

Info

ID:	280879
PubChem CID:	103851723
Reduced:	ON3C16H21 (1)
Stoich.:	AB3C16D21 (1)
Weight, g/mol:	274.091769
ΔH_f, kcal/mol:	11.18
Dipole, Da:	4.07
IP(EA), eV:	-8.52(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(3,5-difluorophenyl)methylamino]phenoxy]acetonitrile

Drug info:

PubChemData

Smile

CC1=C(C=NN1C)CNCCC2=CC3=C(C=C2)OCC3

DOS

IR

Vibrations