Geometry & MOs

Info

ID:	284766
PubChem CID:	104069389
Reduced:	SO3N4C8H14 (1)
Stoich.:	AB3C4D8E14 (1)
Weight, g/mol:	197.152812
ΔH_f, kcal/mol:	-101.16
Dipole, Da:	7.28
IP(EA), eV:	-10.14(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-cyano-2-methylpropyl)-1,1-diethylurea

Drug info:

PubChemData

Smile

C1=C(NC=N1)S(=O)(=O)NCCCCC(=O)N

DOS

IR

Vibrations