Geometry & MOs

Info

ID:	44456
PubChem CID:	10503634
Reduced:	O6C27H28 (1)
Stoich.:	A6B27C28 (1)
Weight, g/mol:	448.257337
ΔH_f, kcal/mol:	-175.08
Dipole, Da:	2.37
IP(EA), eV:	-8.8(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N,4-N-bis[(2S)-1-hydroxy-3-methylbutan-2-yl]-2,5-bis(prop-2-enoxy)benzene-1,4-dicarboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)COC(CC(C(=O)C2=CC=CC=C2)C(=O)OC)COC3=CC=CC=C3

DOS

IR

Vibrations