Geometry & MOs

Info

ID:	339778
PubChem CID:	127261787
Reduced:	ON3H13C14 (1)
Stoich.:	AB3C13D14 (1)
Weight, g/mol:	267.125929
ΔH_f, kcal/mol:	86.55
Dipole, Da:	8.42
IP(EA), eV:	-8.35(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S,5S)-3-(4-methoxyphenyl)-4-methyl-5-phenyl-4,5-dihydro-1,2-oxazole

Drug info:

PubChemData

Smile

CC1=C/C(=C/2\C(=NC(=N2)C3=CC=CC=C3)C)/ON1

DOS

IR

Vibrations