Geometry & MOs

Info

ID:	345387
PubChem CID:	127269687
Reduced:	O2N4C17H28 (1)
Stoich.:	A2B4C17D28 (1)
Weight, g/mol:	284.148455
ΔH_f, kcal/mol:	-80.83
Dipole, Da:	5.82
IP(EA), eV:	-8.74(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,4-dioxan-2-ylmethyl)-3-[1-(2-methoxyethyl)pyrazol-3-yl]urea

Drug info:

PubChemData

Smile

COCCN1C=CC(=N1)NC(=O)NC2CCC3CCCCC3C2

DOS

IR

Vibrations