Geometry & MOs

Info

ID:	299854
PubChem CID:	117703504
Reduced:	FO2N5H18C23 (1)
Stoich.:	AB2C5D18E23 (1)
Weight, g/mol:	275.126991
ΔH_f, kcal/mol:	39.97
Dipole, Da:	3.7
IP(EA), eV:	-9.02(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-tert-butyl-3-(4-methoxy-3-methyl-5-oxo-2H-pyrrol-1-yl)-1,2-oxazole-4-carbonitrile

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CN(C2=NC=CC(=C2)C3=CC=C(C=C3)F)C4=NC=CN=C4)C(=O)NO

DOS

IR

Vibrations