Geometry & MOs

Info

ID:	43277
PubChem CID:	10320621
Reduced:	OC15H20 (2)
Stoich.:	AB15C20 (2)
Weight, g/mol:	432.196841
ΔH_f, kcal/mol:	-82.45
Dipole, Da:	3.04
IP(EA), eV:	-7.9(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[4-[chloro-(6-methyl-4-propylpyridin-3-yl)methyl]phenyl]phenyl]-4,4-dimethyl-5H-1,3-oxazole

Drug info:

PubChemData

Smile

CC(=CCC/C(=C/CC/C(=C/CCC1(CCC2=C(O1)C3=CC=CC=C3C(=C2)O)C)/C)/C)C

DOS

IR

Vibrations