Geometry & MOs

Info

ID:	209035
PubChem CID:	80616157
Reduced:	OSN4C12H20 (1)
Stoich.:	ABC4D12E20 (1)
Weight, g/mol:	254.120132
ΔH_f, kcal/mol:	-20.76
Dipole, Da:	3.63
IP(EA), eV:	-8.98(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cycloheptyl-5-(methylamino)-1,3,4-thiadiazole-2-carboxamide

Drug info:

PubChemData

Smile

CCNC1=NN=C(S1)C(=O)NC2CCCCCC2

DOS

IR

Vibrations