Geometry & MOs

Info

ID:	214743
PubChem CID:	85083569
Reduced:	N4O7C33H34 (1)
Stoich.:	A4B7C33D34 (1)
Weight, g/mol:	598.300264
ΔH_f, kcal/mol:	-228.3
Dipole, Da:	4.67
IP(EA), eV:	-9.36(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2,6-bis[3-[acetyl(phenylmethoxy)amino]propanoylamino]hexanoate

Drug info:

PubChemData

Smile

C1CC(=O)N(C1C(=O)NC(CC2=CC=C(C=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=C(C=C4)O)C(=O)O)CC5=CC=CC=C5

DOS

IR

Vibrations