Geometry & MOs

Info

ID:	352217
PubChem CID:	127283299
Reduced:	SN2O3C13H24 (1)
Stoich.:	AB2C3D13E24 (1)
Weight, g/mol:	304.178693
ΔH_f, kcal/mol:	-160.32
Dipole, Da:	6.11
IP(EA), eV:	-9.83(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[cyclobutyl(phenyl)methyl]-3-(1,4-dioxan-2-ylmethyl)urea

Drug info:

PubChemData

Smile

CCC1CCCCC1NC(=O)N2CCS(=O)(=O)CC2

DOS

IR

Vibrations