Geometry & MOs

Info

ID:	182696
PubChem CID:	76928820
Reduced:	N3O3C8H17 (1)
Stoich.:	A3B3C8D17 (1)
Weight, g/mol:	290.09906
ΔH_f, kcal/mol:	-98.32
Dipole, Da:	1.32
IP(EA), eV:	-9.11(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-amino-2-hydroxyiminoethyl)-1-methyl-3-[4-(trifluoromethyl)phenyl]urea

Drug info:

PubChemData

Smile

CCN(CC(=NO)N)C(=O)COCC

DOS

IR

Vibrations