Geometry & MOs

Info

ID:

191210

PubChem CID:

78118101

Reduced:

NO2C17H23 (1)

Stoich.:

AB2C17D23 (1)

Weight, g/mol:

1407.889381

ΔHf, kcal/mol:

-86.35

Dipole, Da:

6.1

IP(EA), eV:

-9.28(0.45)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[3-[[2-[(2-acetamidocyclopentanecarbonyl)amino]cyclopentanecarbonyl]amino]-5-methylhexanoyl]amino]cyclopentanecarbonyl]amino]cyclopentanecarbonyl]amino]cyclopentanecarbonyl]amino]cyclopentanecarbonyl]amino]cyclopentanecarbonyl]amino]cyclopentanecarbonyl]amino]cyclopentanecarbonyl]amino]cyclopentanecarbonyl]amino]cyclopentane-1-carboxamide

Drug info:

PubChemData

Smile

CC1C2C(CCCC2OC)NC(=O)C1C3=CC=CC=C3

DOS

IR

Vibrations