Geometry & MOs

Info

ID:	280106
PubChem CID:	103846910
Reduced:	FINO2C11H11 (1)
Stoich.:	ABCD2E11F11 (1)
Weight, g/mol:	290.199428
ΔH_f, kcal/mol:	-78.4
Dipole, Da:	5.03
IP(EA), eV:	-9.98(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(4-ethyl-3-methylpiperazin-1-yl)-2-phenylacetate

Drug info:

PubChemData

Smile

C1CC1(CO)NC(=O)C2=C(C=C(C=C2)F)I

DOS

IR

Vibrations