Geometry & MOs

Info

ID:	69578
PubChem CID:	47193875
Reduced:	ION2C13H17 (1)
Stoich.:	ABC2D13E17 (1)
Weight, g/mol:	358.05421
ΔH_f, kcal/mol:	-22.05
Dipole, Da:	5.67
IP(EA), eV:	-8.8(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-butyl-1-cyclopropyl-3-(4-iodophenyl)urea

Drug info:

PubChemData

Smile

C1CCC(C1)CNC(=O)NC2=CC=C(C=C2)I

DOS

IR

Vibrations