Geometry & MOs

Info

ID:

221694

PubChem CID:

85285994

Reduced:

N2O4C15H26 (2)

Stoich.:

A2B4C15D26 (2)

Weight, g/mol:

596.328394

ΔHf, kcal/mol:

-420.39

Dipole, Da:

3.92

IP(EA), eV:

 -10.07(-0.36)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl 2-[[4-[[2-cyclohexylethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]-2-(2-methylphenyl)benzoyl]amino]-4-methylsulfanylbutanoate

Drug info:

PubChemData

Smile

CCCCCCCCNC(=O)CN1C(C(=O)N(C(C1=O)CC(=O)OC)CC(=O)NCCCCCCCC)CC(=O)OC

DOS

IR

Vibrations