Geometry & MOs

Info

ID:

132305

PubChem CID:

51341040

Reduced:

N3O20C42H79 (2)

Stoich.:

A3B20C42D79 (2)

Weight, g/mol:

1116.540101

ΔHf, kcal/mol:

-1763.88

Dipole, Da:

3.66

IP(EA), eV:

 -9.09(-0.7)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

9H-fluoren-9-ylmethyl N-[(2R)-1-[[[4-[2-[bis(4-methylphenyl)methylamino]-2-oxoethoxy]phenyl]-(2,4-dimethoxyphenyl)methyl]amino]-6-[[(4-methylphenyl)-diphenylmethyl]amino]-1-oxohexan-2-yl]carbamate

Drug info:

PubChemData

Smile

COCCOCCOCCOCCOCCOCCOCCOCCNC(=O)CCOCC(COCCC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOC)(COCCC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOC)NC(=O)CCOCCOCCOCCOCCNC(=O)CCCC(=O)ON1C(=O)CCC1=O

DOS

IR

Vibrations