Geometry & MOs

Info

ID:	18713
PubChem CID:	546826
Reduced:	IN2O3C17H31 (1)
Stoich.:	AB2C3D17E31 (1)
Weight, g/mol:	438.13794
ΔH_f, kcal/mol:	-175.84
Dipole, Da:	3.68
IP(EA), eV:	-9.38(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-tert-butyl-5-(4-iodobutyl)-3-methyl-4-oxoimidazolidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)C1N(C(=O)C(N1C(=O)OC(C)(C)C)CCCCI)C

DOS

IR

Vibrations