Geometry & MOs

Info

ID:	51127
PubChem CID:	12013751
Reduced:	NO3H23C26 (1)
Stoich.:	AB3C23D26 (1)
Weight, g/mol:	401.118257
ΔH_f, kcal/mol:	14.47
Dipole, Da:	3.11
IP(EA), eV:	-8.75(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-1-[3-(4-chlorophenyl)-5-phenyl-4,5-dihydro-1,2-oxazol-4-yl]-2-methyl-3-phenylprop-2-en-1-one

Drug info:

PubChemData

Smile

C/C(=C/C1=CC=CC=C1)/C(=O)C2C(ON=C2C3=CC=C(C=C3)OC)C4=CC=CC=C4

DOS

IR

Vibrations