Geometry & MOs

Info

ID:	391525
PubChem CID:	135006198
Reduced:	N2C25H26 (1)
Stoich.:	A2B25C26 (1)
Weight, g/mol:	473.199094
ΔH_f, kcal/mol:	85.55
Dipole, Da:	2.89
IP(EA), eV:	-9.38(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-4-benzyl-2-(3-methylphenyl)-4-[(1R)-3-oxo-1,3-diphenylpropyl]-1,3-oxazol-5-one

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)[C@H](C#N)NC(C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations