Geometry & MOs

Info

ID:	171438
PubChem CID:	75377160
Reduced:	SO2N3C18H21 (1)
Stoich.:	AB2C3D18E21 (1)
Weight, g/mol:	342.151433
ΔH_f, kcal/mol:	-51.14
Dipole, Da:	2.89
IP(EA), eV:	-8.82(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-imidazol-1-ylpyridin-3-yl)-(1-thia-4-azaspiro[5.5]undecan-4-yl)methanone

Drug info:

PubChemData

Smile

C1CCC2(CC1)CN(CCS2)C(=O)C3=NNC(=O)C4=CC=CC=C43

DOS

IR

Vibrations