Geometry & MOs

Info

ID:	217331
PubChem CID:	85087631
Reduced:	FINOZnH5C9 (1)
Stoich.:	ABCDEF5G9 (1)
Weight, g/mol:	353.140927
ΔH_f, kcal/mol:	-9.06
Dipole, Da:	3.84
IP(EA), eV:	-7.68(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-(4-nitrophenyl)-2-(4-sulfanylbutanoylamino)pentanamide

Drug info:

PubChemData

Smile

C1=CC2=C(C(=C(C=C2F)I)O)N=C1.[Zn+2]

DOS

IR

Vibrations