Geometry & MOs

Info

ID:	45895
PubChem CID:	10518788
Reduced:	BrC17H23 (1)
Stoich.:	AB17C23 (1)
Weight, g/mol:	307.120843
ΔH_f, kcal/mol:	-21.81
Dipole, Da:	3.16
IP(EA), eV:	-9.12(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]ethanone

Drug info:

PubChemData

Smile

CC1(CCC2(CCCC3=C2C=CC(=C3)Br)CC1)C

DOS

IR

Vibrations