Geometry & MOs

Info

ID:	261035
PubChem CID:	103215307
Reduced:	ClIN3C13H15 (1)
Stoich.:	ABC3D13E15 (1)
Weight, g/mol:	374.99992
ΔH_f, kcal/mol:	71.18
Dipole, Da:	4.17
IP(EA), eV:	-9.45(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-chloro-4-iodophenyl)-(1-propylimidazol-2-yl)methanamine

Drug info:

PubChemData

Smile

CCNC(C1=CC(=C(C=C1)I)Cl)C2=CC=NN2C

DOS

IR

Vibrations