Geometry & MOs

Info

ID:	287800
PubChem CID:	104294703
Reduced:	OF2N2C16H20 (1)
Stoich.:	AB2C2D16E20 (1)
Weight, g/mol:	274.116921
ΔH_f, kcal/mol:	-136.68
Dipole, Da:	3.45
IP(EA), eV:	-9.04(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,4-difluoro-5-methylphenyl)-(4-propylphenyl)methanone

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)F)C(=O)NC2CC[C@H]3CNC[C@H]3C2

DOS

IR

Vibrations