Geometry & MOs

Info

ID:	200094
PubChem CID:	79346922
Reduced:	FNC12H16 (1)
Stoich.:	ABC12D16 (1)
Weight, g/mol:	291.084849
ΔH_f, kcal/mol:	-21.02
Dipole, Da:	2.87
IP(EA), eV:	-8.96(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-(4-chlorophenyl)thiophen-2-yl]-N-propylprop-2-en-1-amine

Drug info:

PubChemData

Smile

CCCNCC=CC1=CC=CC=C1F

DOS

IR

Vibrations