Geometry & MOs

Info

ID:	446271
PubChem CID:	135273676
Reduced:	IOPN2C12H14 (1)
Stoich.:	ABCD2E12F14 (1)
Weight, g/mol:	335.03823
ΔH_f, kcal/mol:	-3.65
Dipole, Da:	3.5
IP(EA), eV:	-8.93(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-iodo-2,3,3-trimethylpentan-2-yl)pyrrole-2,5-dione

Drug info:

PubChemData

Smile

CCC1(CC1)OC2=CC3=C(C=C2)C=NN3PI

DOS

IR

Vibrations