Geometry & MOs

Info

ID:	263970
PubChem CID:	103411217
Reduced:	N2O3C14H20 (1)
Stoich.:	A2B3C14D20 (1)
Weight, g/mol:	315.160121
ΔH_f, kcal/mol:	-87.35
Dipole, Da:	2.93
IP(EA), eV:	-8.85(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-chloro-2-[3-(2-methoxyethoxy)propoxy]phenyl]butan-2-amine

Drug info:

PubChemData

Smile

COCCOCCCN1C=C(C2=C1N=CC=C2)CO

DOS

IR

Vibrations