Geometry & MOs

Info

ID:	23604
PubChem CID:	605084
Reduced:	NF3O4C17H20 (1)
Stoich.:	AB3C4D17E20 (1)
Weight, g/mol:	359.134443
ΔH_f, kcal/mol:	-301.16
Dipole, Da:	5.42
IP(EA), eV:	-9.95(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-[(3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl)amino]pent-2-enoate

Drug info:

PubChemData

Smile

CCOC(=O)C=CC(C)NC(=O)C(C1=CC=CC=C1)(C(F)(F)F)OC

DOS

IR

Vibrations