Geometry & MOs

Info

ID:	144937
PubChem CID:	53434412
Reduced:	NOC12H15 (1)
Stoich.:	ABC12D15 (1)
Weight, g/mol:	211.137242
ΔH_f, kcal/mol:	-7.45
Dipole, Da:	4.31
IP(EA), eV:	-9.44(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(3-fluoropropoxy)phenyl]propan-1-amine

Drug info:

PubChemData

Smile

COCCC1=CC=C(C=C1)CCC#N

DOS

IR

Vibrations