Geometry & MOs

Info

ID:	197637
PubChem CID:	78983854
Reduced:	N3O3C13H25 (1)
Stoich.:	A3B3C13D25 (1)
Weight, g/mol:	231.137162
ΔH_f, kcal/mol:	-149.73
Dipole, Da:	2.55
IP(EA), eV:	-8.71(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-cyano-2-methylphenyl)-1,1-diethylurea

Drug info:

PubChemData

Smile

CCNC(=O)C(C)N1CCN(CC1)CCC(=O)OC

DOS

IR

Vibrations