Geometry & MOs

Info

ID:	362217
PubChem CID:	127307230
Reduced:	ON5C20H27 (1)
Stoich.:	AB5C20D27 (1)
Weight, g/mol:	280.135782
ΔH_f, kcal/mol:	0.99
Dipole, Da:	4.76
IP(EA), eV:	-8.73(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3,4-thiadiazol-2-yl)-2-azaspiro[5.5]undecane-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NN(C(=C1)NC(=O)N2CCCC3(C2)CCCCC3)C4=CC=CC=N4

DOS

IR

Vibrations