Geometry & MOs

Info

ID:	177052
PubChem CID:	76131155
Reduced:	N2O13C18H32 (1)
Stoich.:	A2B13C18D32 (1)
Weight, g/mol:	450.260722
ΔH_f, kcal/mol:	-562.8
Dipole, Da:	8.69
IP(EA), eV:	-10.21(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[2-[(2-amino-4-methylpentanoyl)amino]pentanoylamino]pentanoyl-methylamino]ethylphosphonic acid

Drug info:

PubChemData

Smile

CC(C(=O)O)OC(C(C=O)N)C(C(CO)O)OC(=O)C(C)OC1C(C(OC(C1O)CO)O)N

DOS

IR

Vibrations