Geometry & MOs

Info

ID:	69550
PubChem CID:	47193730
Reduced:	FION2H12C14 (1)
Stoich.:	ABCD2E12F14 (1)
Weight, g/mol:	389.09641
ΔH_f, kcal/mol:	-27.23
Dipole, Da:	4.6
IP(EA), eV:	-8.9(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(dimethylamino)-2-ethylbutyl]-3-(4-iodophenyl)urea

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)F)CNC(=O)NC2=CC=C(C=C2)I

DOS

IR

Vibrations