Geometry & MOs

Info

ID:	190164
PubChem CID:	77960449
Reduced:	O4C13H18 (1)
Stoich.:	A4B13C18 (1)
Weight, g/mol:	481.201986
ΔH_f, kcal/mol:	-179.93
Dipole, Da:	5.64
IP(EA), eV:	-9.26(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[[3-[[1-(3-chlorophenyl)-2-methylpropan-2-yl]amino]-2-hydroxypropoxy]methyl]phenyl]-2-methylbenzoic acid

Drug info:

PubChemData

Smile

CC(C)C(CC1=CC(=C(C=C1)CO)O)C(=O)O

DOS

IR

Vibrations