Geometry & MOs

Info

ID:	194428
PubChem CID:	78534528
Reduced:	ClFNO4H21C22 (1)
Stoich.:	ABCD4E21F22 (1)
Weight, g/mol:	389.05
ΔH_f, kcal/mol:	-175.24
Dipole, Da:	7.73
IP(EA), eV:	-9.16(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 3-(2-chloro-6-fluorophenyl)prop-2-enoate

Drug info:

PubChemData

Smile

CC(C)CC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C=CC2=C(C=CC=C2Cl)F

DOS

IR

Vibrations