Geometry & MOs

Info

ID:	351171
PubChem CID:	127279729
Reduced:	NSO4C20H29 (1)
Stoich.:	ABC4D20E29 (1)
Weight, g/mol:	374.141262
ΔH_f, kcal/mol:	-186.32
Dipole, Da:	4.92
IP(EA), eV:	-8.5(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[2-(cyclopentylamino)-2-oxoethyl]pyrazol-4-yl]-6,7-dihydro-4H-thieno[3,2-c]pyran-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NC1=CC2=C(C=C1)OCCC2)S(=O)(=O)C3CCCCC3

DOS

IR

Vibrations