Geometry & MOs

Info

ID:	184794
PubChem CID:	77207853
Reduced:	NO11C31H49 (1)
Stoich.:	AB11C31D49 (1)
Weight, g/mol:	569.298867
ΔH_f, kcal/mol:	-514.49
Dipole, Da:	3.75
IP(EA), eV:	-9.41(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[3-[3,4-bis(2,2-dimethylbutanoyloxy)phenyl]-1-methoxy-1-oxopropan-2-yl]amino]propan-2-yl benzoate

Drug info:

PubChemData

Smile

CCCC(C)OC(=O)OC1=C(C=C(C=C1)CC(CC(C)OC(=O)OCCC(C)C)(C(=O)OC)N)OC(=O)OC(C)CCC

DOS

IR

Vibrations