Geometry & MOs

Info

ID:	69555
PubChem CID:	47193735
Reduced:	IN2O2C14H15 (1)
Stoich.:	AB2C2D14E15 (1)
Weight, g/mol:	370.02906
ΔH_f, kcal/mol:	-27.87
Dipole, Da:	5.28
IP(EA), eV:	-8.81(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-iodophenyl)-3-(1-pyrazol-1-ylpropan-2-yl)urea

Drug info:

PubChemData

Smile

CC(CC1=CC=CO1)NC(=O)NC2=CC=C(C=C2)I

DOS

IR

Vibrations