Geometry & MOs

Info

ID:	151583
PubChem CID:	53837819
Reduced:	OSN2C3H4 (1)
Stoich.:	ABC2D3E4 (1)
Weight, g/mol:	380.293997
ΔH_f, kcal/mol:	63.16
Dipole, Da:	2.58
IP(EA), eV:	-9.23(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,6-tris(ethenyl)-3,5-dimethylidene-6-[1-(1,2,2,3-tetramethylpiperidin-4-yl)ethenyl]-1,7-diazabicyclo[2.2.1]heptan-4-amine

Drug info:

PubChemData

Smile

C1N2C=CN1S2=O

DOS

IR

Vibrations