Geometry & MOs

Info

ID:	63628
PubChem CID:	26758812
Reduced:	NF2O5H17C19 (1)
Stoich.:	AB2C5D17E19 (1)
Weight, g/mol:	377.107479
ΔH_f, kcal/mol:	-238.01
Dipole, Da:	4.98
IP(EA), eV:	-8.81(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(2,5-difluoroanilino)-1-oxopropan-2-yl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations