Geometry & MOs

Info

ID:	38481
PubChem CID:	8133084
Reduced:	FN2O2H15C17 (1)
Stoich.:	AB2C2D15E17 (1)
Weight, g/mol:	334.132885
ΔH_f, kcal/mol:	-46.9
Dipole, Da:	5.37
IP(EA), eV:	-9.14(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]-2-oxoethyl] (E)-3-(3-fluorophenyl)prop-2-enoate

Drug info:

PubChemData

Smile

CN(CC1=CC=CC=C1)CN2C3=C(C=C(C=C3)F)C(=O)C2=O

DOS

IR

Vibrations