Geometry & MOs

Info

ID:	7183
PubChem CID:	71486
Reduced:	ClNO5C19H30 (1)
Stoich.:	ABC5D19E30 (1)
Weight, g/mol:	387.181251
ΔH_f, kcal/mol:	-265.26
Dipole, Da:	5.62
IP(EA), eV:	-9.15(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2,2-dimethylpropanoyloxy)-4-[1-hydroxy-2-(methylamino)ethyl]phenyl] 2,2-dimethylpropanoate;hydrochloride

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)OC1=C(C=C(C=C1)C(CNC)O)OC(=O)C(C)(C)C.Cl

DOS

IR

Vibrations