Geometry & MOs

Info

ID:

221763

PubChem CID:

85286118

Reduced:

N6O7C32H38 (1)

Stoich.:

A6B7C32D38 (1)

Weight, g/mol:

618.330502

ΔHf, kcal/mol:

-262.45

Dipole, Da:

4.16

IP(EA), eV:

 -8.26(-0.37)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

6,6-dimethyl-3-(2-methylpropyl)-16-(4-phenylbut-3-en-2-yl)-10-(phenylmethoxymethyl)-1,4-dioxa-8,11-diazacyclohexadec-13-ene-2,5,9,12-tetrone

Drug info:

PubChemData

Smile

CC(=O)NC(CC1=C(NC2=CC=CC=C21)C3=C(C4=CC=CC=C4N3)CC(C(=O)OC)NC(=O)C)C(=O)NNC(=O)OC(C)(C)C

DOS

IR

Vibrations