Geometry & MOs

Info

ID:	361489
PubChem CID:	127303634
Reduced:	SN3O4C11H19 (1)
Stoich.:	AB3C4D11E19 (1)
Weight, g/mol:	294.103814
ΔH_f, kcal/mol:	-174.79
Dipole, Da:	5.77
IP(EA), eV:	-9.72(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(6,7-dihydro-4H-thieno[3,2-c]pyran-2-carbonyl)-3,3-dimethylpiperazin-2-one

Drug info:

PubChemData

Smile

CC1(C(=O)NCCN1C(=O)CN2CCCS2(=O)=O)C

DOS

IR

Vibrations