Geometry & MOs

Info

ID:	89528
PubChem CID:	49962265
Reduced:	ClNOC15H16 (1)
Stoich.:	ABCD15E16 (1)
Weight, g/mol:	269.154642
ΔH_f, kcal/mol:	-9.2
Dipole, Da:	1.86
IP(EA), eV:	-8.29(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-chlorophenoxy)ethyl]heptan-1-amine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NCCOC2=CC=C(C=C2)Cl

DOS

IR

Vibrations