Geometry & MOs

Info

ID:	215996
PubChem CID:	85085555
Reduced:	NOSC11H15 (1)
Stoich.:	ABCD11E15 (1)
Weight, g/mol:	209.098669
ΔH_f, kcal/mol:	-14.55
Dipole, Da:	6.7
IP(EA), eV:	-9.38(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-cyclohexylethenyl)-1,3,4-thiadiazol-2-amine

Drug info:

PubChemData

Smile

CC1(C2CCC1(C(=O)C2SC#N)C)C

DOS

IR

Vibrations