Geometry & MOs

Info

ID:	303901
PubChem CID:	124490760
Reduced:	ClNOC15H18 (1)
Stoich.:	ABCD15E18 (1)
Weight, g/mol:	263.107692
ΔH_f, kcal/mol:	-23.28
Dipole, Da:	3.29
IP(EA), eV:	-8.96(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[4-[(2S)-butan-2-yl]phenyl]-2-[(1R)-1-chloroethyl]-1,3-oxazole

Drug info:

PubChemData

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CC[C@@H](C)C1=CC=C(C=C1)C2=CN=C(O2)[C@@H](C)Cl

DOS

IR

Vibrations