Geometry & MOs

Info

ID:	169320
PubChem CID:	75088989
Reduced:	NOC4H6 (2)
Stoich.:	ABC4D6 (2)
Weight, g/mol:	165.095378
ΔH_f, kcal/mol:	-62.81
Dipole, Da:	3.25
IP(EA), eV:	-9.22(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-fluorophenyl)but-2-en-1-amine

Drug info:

PubChemData

Smile

CC(C(=O)O)N1C=CC=C1CN

DOS

IR

Vibrations