Geometry & MOs

Info

ID:	264807
PubChem CID:	103491320
Reduced:	NO2C15H29 (1)
Stoich.:	AB2C15D29 (1)
Weight, g/mol:	414.90802
ΔH_f, kcal/mol:	-110.97
Dipole, Da:	1.43
IP(EA), eV:	-9.23(1.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[(2-bromo-3-fluorophenyl)methylamino]-2-iodopropanoate

Drug info:

PubChemData

Smile

CCOCC(C)OC1CC(C12CCCCCC2)N

DOS

IR

Vibrations