Geometry & MOs

Info

ID:	30290
PubChem CID:	841094
Reduced:	NCl2O2H15C16 (1)
Stoich.:	AB2C2D15E16 (1)
Weight, g/mol:	347.02694
ΔH_f, kcal/mol:	-65.5
Dipole, Da:	3.62
IP(EA), eV:	-9.09(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-bromobenzoyl)amino]-3-(4-methylphenyl)urea

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)OCC(=O)NC2=C(C=C(C=C2)Cl)Cl)C

DOS

IR

Vibrations