Geometry & MOs

Info

ID:	368957
PubChem CID:	127330976
Reduced:	SO3N4C17H28 (1)
Stoich.:	AB3C4D17E28 (1)
Weight, g/mol:	386.177647
ΔH_f, kcal/mol:	-118.39
Dipole, Da:	2.43
IP(EA), eV:	-8.9(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-yl)-3-[[2-(piperidin-1-ylmethyl)phenyl]methyl]urea

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)NC1=NC2=C(S1)COCC2)N3CCOCC3

DOS

IR

Vibrations