Geometry & MOs

Info

ID:

167474

PubChem CID:

74833593

Reduced:

SN6O8C38H40 (1)

Stoich.:

AB6C8D38E40 (1)

Weight, g/mol:

754.278484

ΔHf, kcal/mol:

-116.38

Dipole, Da:

6.9

IP(EA), eV:

 -9.15(-1.12)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[4-(cyclopropylsulfonylcarbamoyl)-18-(fluoren-9-ylideneamino)oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-en-14-yl]-3-methyl-1,2-oxazole-5-carboxamide

Drug info:

PubChemData

Smile

C1CCC=CC2CC2(NC(=O)C3CC(CN3C(=O)C(CC1)NC(=O)C4=CC=NO4)ON=C5C6=CC=CC=C6C7=CC=CC=C75)C(=O)NS(=O)(=O)C8CC8

DOS

IR

Vibrations