Geometry & MOs

Info

ID:	136182
PubChem CID:	51992479
Reduced:	NO2C14H15 (2)
Stoich.:	AB2C14D15 (2)
Weight, g/mol:	385.10002
ΔH_f, kcal/mol:	-83.07
Dipole, Da:	14.45
IP(EA), eV:	-8.61(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-N-[[3-[(2,6-dichlorophenyl)methoxy]phenyl]methyl]-1-phenylethanamine

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)C[NH2+][C@@H](CC2=CNC3=CC=CC=C32)C(=O)[O-])OCC4=CC=CC(=C4)C

DOS

IR

Vibrations