Geometry & MOs

Info

ID:	352110
PubChem CID:	127283178
Reduced:	BrN2S2O4C12H13 (1)
Stoich.:	AB2C2D4E12F13 (1)
Weight, g/mol:	372.089226
ΔH_f, kcal/mol:	-130.32
Dipole, Da:	2.72
IP(EA), eV:	-9.53(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2,4,8,8-tetraoxo-8lambda6-thia-1,3-diazaspiro[4.5]decan-3-yl)methyl]indolizine-1-carbonitrile

Drug info:

PubChemData

Smile

C1CS(=O)(=O)CCC12C(=O)N(C(=O)N2)CC3=CSC(=C3)Br

DOS

IR

Vibrations