Geometry & MOs

Info

ID:

433089

PubChem CID:

135173226

Reduced:

N2H32C43 (1)

Stoich.:

A2B32C43 (1)

Weight, g/mol:

479.251917

ΔHf, kcal/mol:

204.08

Dipole, Da:

3.24

IP(EA), eV:

 -8.04(-0.44)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-O-benzyl 1-O,1-O-diethyl 2-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]pentane-1,1,5-tricarboxylate

Drug info:

PubChemData

Smile

CC1=C(N(C2=CC=CC=C12)C3=CC=CC(=C3)C4=CC5=C(C=C4)C(C6=CC=CC=C65)(C7=CC=CC=C7)C8=CC=CC=N8)/C=C\C=C

DOS

IR

Vibrations