Geometry & MOs

Info

ID:	364134
PubChem CID:	127314307
Reduced:	OSN5C13H15 (1)
Stoich.:	ABC5D13E15 (1)
Weight, g/mol:	320.173607
ΔH_f, kcal/mol:	22.69
Dipole, Da:	0.94
IP(EA), eV:	-9.67(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(1,3-benzodioxol-5-yl)-2-methylpropyl]-3-[(3-methyloxetan-3-yl)methyl]urea

Drug info:

PubChemData

Smile

CC1=NC=C(S1)CNC(=O)N2CCC3=CN=CN=C3C2

DOS

IR

Vibrations