Geometry & MOs

Info

ID:	72518
PubChem CID:	48416262
Reduced:	N2O5C22H32 (1)
Stoich.:	A2B5C22D32 (1)
Weight, g/mol:	405.175165
ΔH_f, kcal/mol:	-228.06
Dipole, Da:	5.24
IP(EA), eV:	-8.65(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[3-(3,4-difluorophenyl)propanoylamino]methyl]-3-(4-ethoxyphenyl)propanoate

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)CC(CNC(=O)CN2CCCCCCC2=O)C(=O)OC

DOS

IR

Vibrations