Geometry & MOs

Info

ID:

168918

PubChem CID:

75040876

Reduced:

N5O8C24H41 (1)

Stoich.:

A5B8C24D41 (1)

Weight, g/mol:

1600.497484

ΔHf, kcal/mol:

-408.28

Dipole, Da:

7.64

IP(EA), eV:

 -9.9(-0.14)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl 2-[[2-[5,7,16,18-tetraacetyloxy-21-[2-[(2-methoxy-2-oxoethyl)amino]-2-oxoethyl]-3,20-dioxo-6,17-bis[[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy]-9,14,27,28-tetraoxa-2,21-diazatetracyclo[20.2.2.14,8.115,19]octacosa-1(25),22(26),23-trien-2-yl]acetyl]amino]acetate

Drug info:

PubChemData

Smile

CC(C)CC(C(=O)OC)NC(=O)CNC(=O)C1CNC(=O)CN1C(=O)C(C(C)C)NC(=O)OC(C)(C)C

DOS

IR

Vibrations