Geometry & MOs

Info

ID:	184788
PubChem CID:	77207326
Reduced:	NO10C23H33 (1)
Stoich.:	AB10C23D33 (1)
Weight, g/mol:	565.325082
ΔH_f, kcal/mol:	-435.21
Dipole, Da:	6.96
IP(EA), eV:	-9.38(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3,3-dimethylbutanoyloxy)-4-[3-methoxy-3-oxo-2-(2-pentan-2-yloxycarbonyloxyethylamino)propyl]phenyl] 3,3-dimethylbutanoate

Drug info:

PubChemData

Smile

CCOC(=O)OC1=C(C=C(C=C1)CC(C(=O)O)NCC(C)OC(=O)C(C)(C)C)OC(=O)OCC

DOS

IR

Vibrations