Geometry & MOs

Info

ID:	63634
PubChem CID:	26758824
Reduced:	NO7C21H23 (1)
Stoich.:	AB7C21D23 (1)
Weight, g/mol:	385.152537
ΔH_f, kcal/mol:	-227.01
Dipole, Da:	6.9
IP(EA), eV:	-8.09(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(2-ethoxyanilino)-1-oxopropan-2-yl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations