Geometry & MOs

Info

ID:	383709
PubChem CID:	134975583
Reduced:	OC7H15 (2)
Stoich.:	AB7C15 (2)
Weight, g/mol:	234.153227
ΔH_f, kcal/mol:	-149.55
Dipole, Da:	2.78
IP(EA), eV:	-9.67(2.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-fluorophenyl)-2-(hexylamino)acetonitrile

Drug info:

PubChemData

Smile

CCCCC(C)COCCCCCCCO

DOS

IR

Vibrations