Geometry & MOs

Info

ID:	330810
PubChem CID:	127248217
Reduced:	SN4O4C21H26 (1)
Stoich.:	AB4C4D21E26 (1)
Weight, g/mol:	408.128983
ΔH_f, kcal/mol:	-129.17
Dipole, Da:	5.1
IP(EA), eV:	-9.26(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-3-(1-pyrrolidin-1-ylsulfonylpyrrolidin-3-yl)thieno[2,3-b]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)C1=C(C2=C(S1)N=CC=C2)C3CCN(C3)C(=O)COCCN4CCCC4=O

DOS

IR

Vibrations