Geometry & MOs

Info

ID:	199468
PubChem CID:	79251463
Reduced:	ON2C6H8 (2)
Stoich.:	AB2C6D8 (2)
Weight, g/mol:	325.99161
ΔH_f, kcal/mol:	-65.89
Dipole, Da:	2.48
IP(EA), eV:	-9.25(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-iodophenoxy)methyl]pyridin-4-amine

Drug info:

PubChemData

Smile

CCCC1C(=O)N(C(=O)N1)CC2=NC=CC(=C2)N

DOS

IR

Vibrations