Geometry & MOs

Info

ID:	196458
PubChem CID:	78832952
Reduced:	NO3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	254.131823
ΔH_f, kcal/mol:	-108.59
Dipole, Da:	3.09
IP(EA), eV:	-9.96(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-propan-2-yloxyethyl 3-(4-fluorophenyl)propanoate

Drug info:

PubChemData

Smile

CC(=C)COC(=O)C1=CC=C(C=C1)CNC(=O)C

DOS

IR

Vibrations