Geometry & MOs

Info

ID:	37800
PubChem CID:	8024579
Reduced:	OSN2C10H10 (2)
Stoich.:	ABC2D10E10 (2)
Weight, g/mol:	374.090489
ΔH_f, kcal/mol:	24.49
Dipole, Da:	6.06
IP(EA), eV:	-8.38(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-N-[[(1R,2R)-2-methylcyclohexyl]carbamoyl]acetamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)N1CCC2=CC=CC=C21)SC3=NN=C(S3)NC4=CC=CC=C4OC

DOS

IR

Vibrations