Geometry & MOs

Info

ID:

17411

PubChem CID:

496591

Reduced:

O4N6C29H42 (1)

Stoich.:

A4B6C29D42 (1)

Weight, g/mol:

538.326754

ΔHf, kcal/mol:

-158.59

Dipole, Da:

10.61

IP(EA), eV:

 -9.38(0.16)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[[ethyl-[3-[ethyl-[[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]carbamoyl]amino]propyl]carbamoyl]amino]-N-methyl-3-phenylpropanamide

Drug info:

PubChemData

Smile

CCN(CCCN(CC)C(=O)NC(CC1=CC=CC=C1)C(=O)NC)C(=O)NC(CC2=CC=CC=C2)C(=O)NC

DOS

IR

Vibrations