Geometry & MOs

Info

ID:	69562
PubChem CID:	47193742
Reduced:	IN2O2C12H15 (1)
Stoich.:	AB2C2D12E15 (1)
Weight, g/mol:	384.01349
ΔH_f, kcal/mol:	-52.79
Dipole, Da:	3.59
IP(EA), eV:	-8.91(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-fluorophenyl)methyl]-3-(4-iodophenyl)-1-methylurea

Drug info:

PubChemData

Smile

CC1CN(CCO1)C(=O)NC2=CC=C(C=C2)I

DOS

IR

Vibrations