Geometry & MOs

Info

ID:	443332
PubChem CID:	135258610
Reduced:	ON6C42H44 (1)
Stoich.:	AB6C42D44 (1)
Weight, g/mol:	427.92464
ΔH_f, kcal/mol:	216.1
Dipole, Da:	6.96
IP(EA), eV:	-7.24(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N'-diiodo-2,2-dimethyl-N-phenylpropanimidamide

Drug info:

PubChemData

Smile

CC1N2CCCN3C=CN(C3C)C4=CC=CC=C4C(CC5=CC=CC=C5N1C=C2)C6N(C=CN6C7=C(C=CC8=C7OC9=CC=CC=C89)C)C

DOS

IR

Vibrations