Geometry & MOs

Info

ID:	261020
PubChem CID:	103214378
Reduced:	ClFINOH6C12 (1)
Stoich.:	ABCDEF6G12 (1)
Weight, g/mol:	372.97304
ΔH_f, kcal/mol:	-2.39
Dipole, Da:	2.35
IP(EA), eV:	-9.84(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-chloro-4-iodophenyl)-(2-methoxyphenyl)methanamine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C(=O)C2=C(C=NC=C2)F)Cl)I

DOS

IR

Vibrations