Geometry & MOs

Info

ID:

22515

PubChem CID:

597403

Reduced:

O2N8C31H36 (1)

Stoich.:

A2B8C31D36 (1)

Weight, g/mol:

552.296122

ΔHf, kcal/mol:

17.07

Dipole, Da:

0.44

IP(EA), eV:

 -9.12(0.05)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-amino-N-[1-[[1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]-2-phenylethyl]amino]-1-oxo-3-phenylpropan-2-yl]-3-phenylpropanamide

Drug info:

PubChemData

Smile

CN(C)C1=NC(=NC(=N1)N)C(CC2=CC=CC=C2)NC(=O)C(CC3=CC=CC=C3)NC(=O)C(CC4=CC=CC=C4)N

DOS

IR

Vibrations