Geometry & MOs

Info

ID:	345989
PubChem CID:	127270306
Reduced:	O2S2N5C15H23 (1)
Stoich.:	A2B2C5D15E23 (1)
Weight, g/mol:	355.113667
ΔH_f, kcal/mol:	-64.03
Dipole, Da:	1.43
IP(EA), eV:	-8.82(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,3,4-thiadiazol-2-yl)-3-[4-(thiomorpholine-4-carbonyl)cyclohexyl]urea

Drug info:

PubChemData

Smile

CC1=NN=C(S1)NC(=O)NC2CCC(CC2)C(=O)N3CCSCC3

DOS

IR

Vibrations