Geometry & MOs

Info

ID:	209732
PubChem CID:	80709489
Reduced:	NO2C7H13 (2)
Stoich.:	AB2C7D13 (2)
Weight, g/mol:	293.065654
ΔH_f, kcal/mol:	-191.69
Dipole, Da:	5.33
IP(EA), eV:	-9.33(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,5-dimethyl-1H-pyrazol-4-yl)-6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-carboxamide

Drug info:

PubChemData

Smile

COCCCNC(=O)CN(CC(=O)OC)C1CCCC1

DOS

IR

Vibrations