Geometry & MOs

Info

ID:	438338
PubChem CID:	135228071
Reduced:	N2O3C38H46 (1)
Stoich.:	A2B3C38D46 (1)
Weight, g/mol:	592.366493
ΔH_f, kcal/mol:	-62.63
Dipole, Da:	1.65
IP(EA), eV:	-8.78(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[4-[(4-cyclodecylphenyl)methoxy]phenyl]-2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]-4,4-dimethyl-5H-1,3-oxazole

Drug info:

PubChemData

Smile

CC1(COC(=N1)C2=C(C=C(C=C2)C3=CC=C(C=C3)OCC4=CC=C(C=C4)C5CCCCCCCC5)C6=NC(CO6)(C)C)C

DOS

IR

Vibrations