Geometry & MOs

Info

ID:	226744
PubChem CID:	87558014
Reduced:	NSiO7C12H19 (1)
Stoich.:	ABC7D12E19 (1)
Weight, g/mol:	281.131031
ΔH_f, kcal/mol:	-394.58
Dipole, Da:	4.09
IP(EA), eV:	-10.2(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-carbamothioyl-N-(3,5-dimethylpyrazol-1-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CCC[Si](OC(=O)C)(OC(=O)C)OC(=O)CNC(=O)C=C

DOS

IR

Vibrations