Geometry & MOs

Info

ID:

144194

PubChem CID:

53330062

Reduced:

O2N4C27H32 (1)

Stoich.:

A2B4C27D32 (1)

Weight, g/mol:

610.275112

ΔHf, kcal/mol:

-35.64

Dipole, Da:

3.16

IP(EA), eV:

 -8.46(-0.61)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[1-[4-[3-(2-carbamoylpyrrolidin-1-yl)-3-oxo-2-[(5-oxopyrrolidine-2-carbonyl)amino]propyl]imidazol-1-yl]-2-ethoxy-2-oxoethyl] 2-methyl-2-phenylpropanoate

Drug info:

PubChemData

Smile

CCC1CCCN1C(=O)C2=CC=CC(=C2C3=CC4=CC(=C(N=C4C=C3)N)N5CCOCC5)C

DOS

IR

Vibrations