Geometry & MOs

Info

ID:

176354

PubChem CID:

76036999

Reduced:

FSO2N7C23H32 (1)

Stoich.:

ABC2D7E23F32 (1)

Weight, g/mol:

960.477226

ΔHf, kcal/mol:

-54.56

Dipole, Da:

5.62

IP(EA), eV:

 -8.31(-0.46)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

benzyl N-benzyl-N-[2-[4-[5-[(3-hydroxy-3-methylbutanoyl)amino]-3-methoxy-6-methyl-4-phenylmethoxyoxan-2-yl]oxy-6-methyl-3,5-bis(phenylmethoxy)oxan-2-yl]oxyethyl]carbamate

Drug info:

PubChemData

Smile

CN(C1C2CCCC(C2NN1)F)C3=NC(=NC=C3)NC4=CC(=CC(=C4)S(=O)(=O)C)N5CCCC5

DOS

IR

Vibrations