Geometry & MOs

Info

ID:	354597
PubChem CID:	127287214
Reduced:	SO2N3C15H17 (1)
Stoich.:	AB2C3D15E17 (1)
Weight, g/mol:	326.268176
ΔH_f, kcal/mol:	-41.59
Dipole, Da:	4.66
IP(EA), eV:	-9.43(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-ethylpiperidin-3-yl)methyl]-3-(3-morpholin-4-ylbutan-2-yl)urea

Drug info:

PubChemData

Smile

CC1=C(SC=N1)CNC(=O)N[C@H]2[C@H](CC3=CC=CC=C23)O

DOS

IR

Vibrations