Geometry & MOs

Info

ID:	186508
PubChem CID:	77439307
Reduced:	NOC8H12 (2)
Stoich.:	ABC8D12 (2)
Weight, g/mol:	517.336315
ΔH_f, kcal/mol:	-74.83
Dipole, Da:	7.11
IP(EA), eV:	-8.88(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-amino-3-[1-[3-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]propanoylamino]pentan-3-yloxy]cyclohexene-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)N1C2CC(CCC2N3C=CC=C3C1=O)OC

DOS

IR

Vibrations