Geometry & MOs

Info

ID:	438098
PubChem CID:	135227669
Reduced:	ION4H17C20 (1)
Stoich.:	ABC4D17E20 (1)
Weight, g/mol:	443.04946
ΔH_f, kcal/mol:	125.55
Dipole, Da:	5.54
IP(EA), eV:	-8.46(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(2-aminophenyl)-2-iodo-N-(2-methoxyphenyl)benzenecarboximidamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1NC(=NC2=CC=CC=C2N=N)C3=CC=CC=C3I

DOS

IR

Vibrations