Geometry & MOs

Info

ID:	63738
PubChem CID:	26759070
Reduced:	NO5C20H23 (1)
Stoich.:	AB5C20D23 (1)
Weight, g/mol:	395.118044
ΔH_f, kcal/mol:	-172.71
Dipole, Da:	4.28
IP(EA), eV:	-8.85(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl] 3,4-dimethoxybenzoate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations