Geometry & MOs

Info

ID:	63896
PubChem CID:	26759440
Reduced:	FNO5C20H22 (1)
Stoich.:	ABC5D20E22 (1)
Weight, g/mol:	375.148201
ΔH_f, kcal/mol:	-222.18
Dipole, Da:	5.32
IP(EA), eV:	-8.57(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations