Geometry & MOs

Info

ID:	386091
PubChem CID:	134980755
Reduced:	O2C21H30 (1)
Stoich.:	A2B21C30 (1)
Weight, g/mol:	297.172879
ΔH_f, kcal/mol:	-47.49
Dipole, Da:	6.61
IP(EA), eV:	-7.9(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-4-[(1S)-cyclohex-2-en-1-yl]-4-(2-methylpropyl)-2-phenyl-1,3-oxazol-5-one

Drug info:

PubChemData

Smile

CC(C)[C@H]1C=CC2=CC3=C(CCCC3(CC[C@]12C)C)C(=O)OC

DOS

IR

Vibrations