Geometry & MOs

Info

ID:	185200
PubChem CID:	77268881
Reduced:	N2O5C29H32 (1)
Stoich.:	A2B5C29D32 (1)
Weight, g/mol:	501.122164
ΔH_f, kcal/mol:	-145.9
Dipole, Da:	3.53
IP(EA), eV:	-8.44(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-3-[4-[[3-methyl-5-[4-(trifluoromethyl)phenyl]thiophen-2-yl]methoxy]phenyl]-3-(1,2-oxazol-3-yl)propanoic acid

Drug info:

PubChemData

Smile

C1CN(CCN1C2=CC=C(C=C2)C3=CC=CC=C3)C(=O)C(CCOCC4=CC=CC=C4)C(C(=O)O)O

DOS

IR

Vibrations