Geometry & MOs

Info

ID:	368339
PubChem CID:	127327932
Reduced:	OS3N6C15H22 (1)
Stoich.:	AB3C6D15E22 (1)
Weight, g/mol:	338.177647
ΔH_f, kcal/mol:	30.96
Dipole, Da:	5.84
IP(EA), eV:	-8.34(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-methylcyclohexyl)-3-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]urea

Drug info:

PubChemData

Smile

CCSC1=NN=C(S1)NC(=O)N2CCCN(CC2)CC3=CSC(=N3)C

DOS

IR

Vibrations