Geometry & MOs

Info

ID:	345988
PubChem CID:	127270305
Reduced:	OSN4C15H24 (1)
Stoich.:	ABC4D15E24 (1)
Weight, g/mol:	369.129317
ΔH_f, kcal/mol:	-16.5
Dipole, Da:	3.34
IP(EA), eV:	-8.78(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-methyl-1,3,4-thiadiazol-2-yl)-3-[4-(thiomorpholine-4-carbonyl)cyclohexyl]urea

Drug info:

PubChemData

Smile

CCN(CCNC(=O)NC1=NC2=C(S1)CCCC2)C3CC3

DOS

IR

Vibrations