Geometry & MOs

Info

ID:

190149

PubChem CID:

77959938

Reduced:

NOC26H28 (2)

Stoich.:

ABC26D28 (2)

Weight, g/mol:

444.222014

ΔHf, kcal/mol:

61.85

Dipole, Da:

4.64

IP(EA), eV:

 -7.88(-2.1)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[2-[[2-(2-carbamoylpyrrolidin-1-yl)-2-oxoethyl]carbamoyloxy]-2-methylpropyl] 2-[(2-methylpropan-2-yl)oxycarbonylamino]acetate

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=C2C=CC3=CC=C4C=CC(=C5C=C(C=C(C5=O)C6=CC=C(C=C6)C(C)(C)C)C(C)(C)C)N=C4C3=N2)C(=O)C(C1)C7=CC=C(C=C7)C(C)(C)C

DOS

IR

Vibrations