Geometry & MOs

Info

ID:	280926
PubChem CID:	103851985
Reduced:	NF4C14H15 (1)
Stoich.:	AB4C14D15 (1)
Weight, g/mol:	228.162649
ΔH_f, kcal/mol:	-158.61
Dipole, Da:	5.23
IP(EA), eV:	-9.5(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(1-propylcyclopropyl)methylamino]methyl]benzonitrile

Drug info:

PubChemData

Smile

C#CCCCCNCC1=CC(=C(C=C1)F)C(F)(F)F

DOS

IR

Vibrations