Geometry & MOs

Info

ID:	150376
PubChem CID:	53790065
Reduced:	FO2C33H43 (1)
Stoich.:	AB2C33D43 (1)
Weight, g/mol:	399.160121
ΔH_f, kcal/mol:	-121.62
Dipole, Da:	1.36
IP(EA), eV:	-8.47(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1-[(4-chlorophenyl)methyl]-5-methoxy-3-methylindol-2-yl]-2,2-dimethylbutanoic acid

Drug info:

PubChemData

Smile

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC(=C(C=C3)OCCCC(C)CC)F

DOS

IR

Vibrations