Geometry & MOs

Info

ID:	404288
PubChem CID:	135065754
Reduced:	NF3O3C18H22 (1)
Stoich.:	AB3C3D18E22 (1)
Weight, g/mol:	252.136159
ΔH_f, kcal/mol:	-306.35
Dipole, Da:	3.31
IP(EA), eV:	-10.07(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-2-hydroxy-2-(2-methoxyphenyl)ethyl] 2,2-dimethylpropanoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCCC(C1=O)CC2=CC(=CC=C2)C(F)(F)F

DOS

IR

Vibrations