Geometry & MOs

Info

ID:

383

PubChem CID:

2686

Reduced:

N5O5C31H51 (1)

Stoich.:

A5B5C31D51 (1)

Weight, g/mol:

573.38902

ΔHf, kcal/mol:

-251.44

Dipole, Da:

6.28

IP(EA), eV:

 -8.72(-0.19)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-acetamido-N-[4-[[(2-acetamido-3-methylbutanoyl)amino]-(cyclohexylmethyl)amino]-3-hydroxy-1-phenylbutan-2-yl]-3-methylbutanamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NC(CC1=CC=CC=C1)C(CN(CC2CCCCC2)NC(=O)C(C(C)C)NC(=O)C)O)NC(=O)C

DOS

IR

Vibrations