Geometry & MOs

Info

ID:	268553
PubChem CID:	103599915
Reduced:	FN2O2C11H11 (1)
Stoich.:	AB2C2D11E11 (1)
Weight, g/mol:	258.141993
ΔH_f, kcal/mol:	-109.61
Dipole, Da:	2.68
IP(EA), eV:	-9.73(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-butan-2-yl-4-[(3-fluorophenyl)methoxy]benzene

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)F)N2C(=O)CNC2=O

DOS

IR

Vibrations