Geometry & MOs

Info

ID:	276717
PubChem CID:	103824787
Reduced:	BrClON2C13H16 (1)
Stoich.:	ABCD2E13F16 (1)
Weight, g/mol:	289.98215
ΔH_f, kcal/mol:	-42.4
Dipole, Da:	7.0
IP(EA), eV:	-8.97(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-bromo-3-chlorophenyl)-1-ethyl-1-methylurea

Drug info:

PubChemData

Smile

CC1CCCN(C1)C(=O)NC2=CC(=C(C=C2)Br)Cl

DOS

IR

Vibrations