Geometry & MOs

Info

ID:	203508
PubChem CID:	79839492
Reduced:	ON3C12H15 (1)
Stoich.:	AB3C12D15 (1)
Weight, g/mol:	254.042232
ΔH_f, kcal/mol:	2.51
Dipole, Da:	9.25
IP(EA), eV:	-8.88(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-[(2,4-difluorophenyl)methyl]pyridin-4-amine

Drug info:

PubChemData

Smile

C1CCC(C1)(CNC2=CN=C(C=C2)C#N)O

DOS

IR

Vibrations