Geometry & MOs

Info

ID:	62095
PubChem CID:	26717557
Reduced:	NCl2O2H15C16 (1)
Stoich.:	AB2C2D15E16 (1)
Weight, g/mol:	397.084764
ΔH_f, kcal/mol:	-57.68
Dipole, Da:	4.94
IP(EA), eV:	-9.22(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-1-(3,4-dichlorophenyl)ethyl]-2-(3,4,5-trimethoxyphenyl)acetamide

Drug info:

PubChemData

Smile

C[C@H](C1=CC(=C(C=C1)Cl)Cl)NC(=O)C2=CC(=CC=C2)OC

DOS

IR

Vibrations