Geometry & MOs

Info

ID:	269131
PubChem CID:	103615376
Reduced:	FION3H7C11 (1)
Stoich.:	ABCD3E7F11 (1)
Weight, g/mol:	366.94722
ΔH_f, kcal/mol:	6.51
Dipole, Da:	2.73
IP(EA), eV:	-9.76(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(5-chloro-2-iodobenzoyl)-methylamino]acetate

Drug info:

PubChemData

Smile

C1=CN=C(N=C1)NC(=O)C2=C(C=C(C=C2)F)I

DOS

IR

Vibrations