Geometry & MOs

Info

ID:	312272
PubChem CID:	126604015
Reduced:	OC5H8 (5)
Stoich.:	AB5C8 (5)
Weight, g/mol:	388.256629
ΔH_f, kcal/mol:	-273.13
Dipole, Da:	5.28
IP(EA), eV:	-9.64(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-[3-[1-(4-fluoro-3-methylphenyl)propan-2-yl]-4-methylphenyl]propan-2-yl]-1,3-dimethylbenzene

Drug info:

PubChemData

Smile

CC(C)CCC1=C(C(C(=O)C(=C1OC(=O)C)C(=O)C)(CCC(C)C)CCC(C)C)O

DOS

IR

Vibrations