Geometry & MOs

Info

ID:

146155

PubChem CID:

53644926

Reduced:

O5N6C47H56 (1)

Stoich.:

A5B6C47D56 (1)

Weight, g/mol:

834.446869

ΔHf, kcal/mol:

-151.44

Dipole, Da:

7.52

IP(EA), eV:

 -9.04(-0.85)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-amino-N-[1-[[1-[[1-[(7-amino-2-oxoheptan-3-yl)amino]-3-naphthalen-2-yl-1-oxopropan-2-yl]amino]-3-naphthalen-2-yl-1-oxopropan-2-yl]amino]-3-naphthalen-2-yl-1-oxopropan-2-yl]pentanamide

Drug info:

PubChemData

Smile

CC(=O)C(CCCCN)NC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC2=CC3=CC=CC=C3C=C2)NC(=O)C(CC4=CC5=CC=CC=C5C=C4)N(C)C(=O)CCCN

DOS

IR

Vibrations