Geometry & MOs

Info

ID:	355959
PubChem CID:	127290949
Reduced:	O2N3C13H25 (1)
Stoich.:	A2B3C13D25 (1)
Weight, g/mol:	266.174276
ΔH_f, kcal/mol:	-115.76
Dipole, Da:	1.71
IP(EA), eV:	-8.55(1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methyl-3-pyrazol-1-ylpropyl)-3-(oxan-3-yl)urea

Drug info:

PubChemData

Smile

CCN1CCCC(C1)NC(=O)NC2CCCOC2

DOS

IR

Vibrations