Geometry & MOs

Info

ID:	276464
PubChem CID:	103823491
Reduced:	NOF4C14H17 (1)
Stoich.:	ABC4D14E17 (1)
Weight, g/mol:	218.121927
ΔH_f, kcal/mol:	-215.26
Dipole, Da:	5.95
IP(EA), eV:	-9.4(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[(2-ethylcyclopropyl)amino]methyl]-3-fluorobenzonitrile

Drug info:

PubChemData

Smile

C1CC1COCCNCC2=CC(=CC(=C2)F)C(F)(F)F

DOS

IR

Vibrations