Geometry & MOs

Info

ID:	63997
PubChem CID:	26759645
Reduced:	NF2O4H17C18 (1)
Stoich.:	AB2C4D17E18 (1)
Weight, g/mol:	373.152537
ΔH_f, kcal/mol:	-222.54
Dipole, Da:	5.92
IP(EA), eV:	-9.07(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-(3,4-dimethoxyanilino)-1-oxopropan-2-yl] 2-(4-methoxyphenyl)acetate

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1=CC(=C(C=C1)F)F)OC(=O)CC2=CC=C(C=C2)OC

DOS

IR

Vibrations