Geometry & MOs

Info

ID:	63905
PubChem CID:	26759453
Reduced:	ClNO5C20H22 (1)
Stoich.:	ABC5D20E22 (1)
Weight, g/mol:	371.173273
ΔH_f, kcal/mol:	-184.88
Dipole, Da:	3.67
IP(EA), eV:	-8.57(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(2,6-dimethylanilino)-1-oxopropan-2-yl] 2-(3,4-dimethoxyphenyl)acetate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)Cl)NC(=O)[C@@H](C)OC(=O)CC2=CC(=C(C=C2)OC)OC

DOS

IR

Vibrations