Geometry & MOs

Info

ID:	320322
PubChem CID:	126659511
Reduced:	ClN2C28H39 (1)
Stoich.:	AB2C28D39 (1)
Weight, g/mol:	363.147058
ΔH_f, kcal/mol:	3.77
Dipole, Da:	3.64
IP(EA), eV:	-7.91(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[4-[4-(1-hydroxyethyl)-3-methyl-1,2-oxazol-5-yl]phenyl]phenyl]cyclopropane-1-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)C1=C(C(=CC=C1)C(C)C)N2C=CN(C2(C)Cl)C3=C(C=CC=C3C(C)C)C(C)C

DOS

IR

Vibrations