Geometry & MOs

Info

ID:

220177

PubChem CID:

85165329

Reduced:

N4O7C37H54 (1)

Stoich.:

A4B7C37D54 (1)

Weight, g/mol:

666.39925

ΔHf, kcal/mol:

-325.78

Dipole, Da:

9.35

IP(EA), eV:

 -9.53(-0.15)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[4-[2-[[4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]cyclohexanecarbonyl]amino]-3-(octylamino)-3-oxopropyl]phenyl] pyridin-4-ylmethyl carbonate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC(COCC1=CC=CC=C1)C(=O)NC(CCCCNC(=O)OCC2=CC=CC=C2)C(=O)NCCC3CCCCC3

DOS

IR

Vibrations