Geometry & MOs

Info

ID:	69568
PubChem CID:	47193748
Reduced:	BrION2H14C15 (1)
Stoich.:	ABCD2E14F15 (1)
Weight, g/mol:	384.01349
ΔH_f, kcal/mol:	21.56
Dipole, Da:	5.05
IP(EA), eV:	-8.91(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(4-fluorophenyl)ethyl]-3-(4-iodophenyl)urea

Drug info:

PubChemData

Smile

CN(CC1=CC=C(C=C1)Br)C(=O)NC2=CC=C(C=C2)I

DOS

IR

Vibrations