Geometry & MOs

Info

ID:	279100
PubChem CID:	103841124
Reduced:	N2O3C14H18 (1)
Stoich.:	A2B3C14D18 (1)
Weight, g/mol:	242.163043
ΔH_f, kcal/mol:	-117.25
Dipole, Da:	2.4
IP(EA), eV:	-9.44(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(hydroxymethyl)cyclohexyl]-3-(oxolan-3-yl)urea

Drug info:

PubChemData

Smile

C1COCC1NC(=O)N[C@@H]2[C@@H](CC3=CC=CC=C23)O

DOS

IR

Vibrations