Geometry & MOs

Info

ID:

146154

PubChem CID:

53644925

Reduced:

O4N5C47H51 (1)

Stoich.:

A4B5C47D51 (1)

Weight, g/mol:

784.431219

ΔHf, kcal/mol:

-73.59

Dipole, Da:

3.31

IP(EA), eV:

 -8.86(-0.69)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-amino-N-[1-[[1-[[1-[(7-amino-2-oxoheptan-3-yl)amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-naphthalen-2-yl-1-oxopropan-2-yl]amino]-3-naphthalen-2-yl-1-oxopropan-2-yl]-N-methylbutanamide

Drug info:

PubChemData

Smile

CCCCNC(=O)C(CC1=CC2=CC=CC=C2C=C1)NC(=O)C(CC3=CC4=CC=CC=C4C=C3)NC(=O)C(CC5=CC6=CC=CC=C6C=C5)NC(=O)CCCN

DOS

IR

Vibrations