Geometry & MOs

Info

ID:	63895
PubChem CID:	26759436
Reduced:	NO6C21H25 (1)
Stoich.:	AB6C21D25 (1)
Weight, g/mol:	375.148201
ΔH_f, kcal/mol:	-207.71
Dipole, Da:	3.99
IP(EA), eV:	-8.26(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-(3-fluoro-4-methylanilino)-1-oxopropan-2-yl] 2-(3,4-dimethoxyphenyl)acetate

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1NC(=O)[C@@H](C)OC(=O)CC2=CC(=C(C=C2)OC)OC

DOS

IR

Vibrations