Geometry & MOs

Info

ID:

381052

PubChem CID:

134971679

Reduced:

OPH23C30 (1)

Stoich.:

ABC23D30 (1)

Weight, g/mol:

1113.40809

ΔHf, kcal/mol:

88.85

Dipole, Da:

2.26

IP(EA), eV:

 -8.64(0.08)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

ethyl (8R,11R,14S,15S)-5-bromo-17-[tert-butyl(dimethyl)silyl]oxy-18-chloro-11-(4-methoxyphenyl)-8-[(2-methylpropan-2-yl)oxycarbonylamino]-9,12-dioxo-4-(pyrrolidin-1-yldiazenyl)-15-tri(propan-2-yl)silyloxy-2-oxa-13-azatricyclo[14.2.2.13,7]henicosa-1(18),3,5,7(21),16,19-hexaene-14-carboxylate

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C2=CC3(C=C(P2C4=CC=CC=C43)C5=CC=CC=C5)C6=CC=CC=C6

DOS

IR

Vibrations