Geometry & MOs

Info

ID:	283118
PubChem CID:	103959186
Reduced:	ClNOC16H18 (1)
Stoich.:	ABCD16E18 (1)
Weight, g/mol:	295.053069
ΔH_f, kcal/mol:	-16.77
Dipole, Da:	2.64
IP(EA), eV:	-8.95(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[2-(2,3-dichlorophenoxy)phenyl]propan-1-amine

Drug info:

PubChemData

Smile

CC[C@H](C1=CC=CC=C1OC2=CC(=C(C=C2)Cl)C)N

DOS

IR

Vibrations