Geometry & MOs

Info

ID:

447177

PubChem CID:

135280948

Reduced:

NC15H29 (1)

Stoich.:

AB15C29 (1)

Weight, g/mol:

1498.713769

ΔHf, kcal/mol:

-21.92

Dipole, Da:

1.38

IP(EA), eV:

-8.72(1.36)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-[2-[2-[2,6-bis[(1-methyltriazol-4-yl)methoxycarbonylamino]hexanoyloxy]propyl-[1-[2-[(1-methyltriazol-4-yl)methoxycarbonylamino]acetyl]oxypropyl]amino]ethyl-[2-[2-[(3-methyl-1,2-dihydrotriazol-5-yl)methoxycarbonylamino]acetyl]oxypropyl]amino]propan-2-yl 2,6-bis[(1-methyltriazol-4-yl)methoxycarbonylamino]hexanoate

Drug info:

PubChemData

Smile

CCNC(/C=C\C(C)(C)C/C=C\C)C(C)C

DOS

IR

Vibrations