Geometry & MOs

Info

ID:	375811
PubChem CID:	134221801
Reduced:	NO4C23H27 (1)
Stoich.:	AB4C23D27 (1)
Weight, g/mol:	463.272259
ΔH_f, kcal/mol:	-159.99
Dipole, Da:	6.45
IP(EA), eV:	-8.75(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(cyclohexanecarbonyl)-6-methyl-4-(4-methylphenyl)-2,3-dihydroindol-5-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acid

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=C(C(=CC3=C2CCN3C=O)C)C(C(=O)O)OC(C)(C)C

DOS

IR

Vibrations