Geometry & MOs

Info

ID:	242664
PubChem CID:	97857799
Reduced:	NCl2O3C13H17 (1)
Stoich.:	AB2C3D13E17 (1)
Weight, g/mol:	265.167794
ΔH_f, kcal/mol:	-157.84
Dipole, Da:	2.07
IP(EA), eV:	-9.82(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-(1-hydroxy-2-methylpropan-2-yl)-3-(4-methoxyphenyl)butanamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations