Geometry & MOs

Info

ID:	69567
PubChem CID:	47193747
Reduced:	ClION2H14C15 (1)
Stoich.:	ABCD2E14F15 (1)
Weight, g/mol:	443.93342
ΔH_f, kcal/mol:	9.27
Dipole, Da:	4.09
IP(EA), eV:	-8.86(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(CC1=CC=CC=C1Cl)C(=O)NC2=CC=C(C=C2)I

DOS

IR

Vibrations