Geometry & MOs

Info

ID:

186493

PubChem CID:

77439133

Reduced:

NO10C31H37 (1)

Stoich.:

AB10C31D37 (1)

Weight, g/mol:

710.309098

ΔHf, kcal/mol:

-388.57

Dipole, Da:

1.14

IP(EA), eV:

 -8.96(-1.88)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[4-[4-[2-(2-methyl-2-prop-2-enoyloxycyclopropyl)butan-2-yloxy]benzoyl]oxyphenyl] 4-[1-methyl-2-(2-prop-2-enoyloxybutan-2-yl)cyclopropyl]oxybenzoate

Drug info:

PubChemData

Smile

CCC(=O)C1(CC(C2=C(C1)C(=C3C(=C2O)C(=O)C4=C(C3=O)C=CC=C4OC)O)OC5CC(C(C(O5)C)O)NC(C)C)O

DOS

IR

Vibrations