Geometry & MOs

Info

ID:	352250
PubChem CID:	127283332
Reduced:	SO2N5C18H29 (1)
Stoich.:	AB2C5D18E29 (1)
Weight, g/mol:	326.177647
ΔH_f, kcal/mol:	-71.24
Dipole, Da:	3.39
IP(EA), eV:	-9.15(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[4-(2-methylpropyl)morpholin-2-yl]methyl]-3-[(4-methyl-1,3-thiazol-5-yl)methyl]urea

Drug info:

PubChemData

Smile

CC1=C(SC=N1)CNC(=O)N2CCN(CC2)CC(=O)N3CCCCCC3

DOS

IR

Vibrations