Geometry & MOs

Info

ID:

219312

PubChem CID:

85098705

Reduced:

O5C22H42 (2)

Stoich.:

A5B22C42 (2)

Weight, g/mol:

772.264185

ΔHf, kcal/mol:

-620.05

Dipole, Da:

2.34

IP(EA), eV:

 -10.19(0.33)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl 2-[[2-[[3-[4-[(2,6-dichlorophenyl)methoxy]phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-6-(phenylmethoxycarbonylamino)hexanoyl]amino]acetate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCCC(=O)OCC(COC1C(C(C(C(O1)CO)O)O)O)OC(=O)CCCCCCCCCCCCCCC

DOS

IR

Vibrations