Geometry & MOs

Info

ID:	203505
PubChem CID:	79839482
Reduced:	N3C13H19 (1)
Stoich.:	A3B13C19 (1)
Weight, g/mol:	255.117176
ΔH_f, kcal/mol:	40.3
Dipole, Da:	9.41
IP(EA), eV:	-8.51(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[1-(4-fluorophenyl)propan-2-ylamino]pyridine-2-carbonitrile

Drug info:

PubChemData

Smile

CC(C(C)(C)C)N(C)C1=CN=C(C=C1)C#N

DOS

IR

Vibrations