Geometry & MOs

Info

ID:	433361
PubChem CID:	135173498
Reduced:	SF2N6O6C35H48 (1)
Stoich.:	AB2C6D6E35F48 (1)
Weight, g/mol:	301.01749
ΔH_f, kcal/mol:	-264.93
Dipole, Da:	5.41
IP(EA), eV:	-8.24(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-iodo-2-(5-methoxypentoxy)acetamide

Drug info:

PubChemData

Smile

CCCS(=O)(=O)NC1=C(C(=C(C=C1)F)N2C=C(C3=C2C=CC(=N3)N(C)C4CCN(CC4)CCOCCOCC(=O)OC(C)(C)C)C(=C)C=N)F

DOS

IR

Vibrations