Geometry & MOs

Info

ID:	350382
PubChem CID:	127277460
Reduced:	SO3N4C15H22 (1)
Stoich.:	AB3C4D15E22 (1)
Weight, g/mol:	336.161997
ΔH_f, kcal/mol:	-104.12
Dipole, Da:	7.91
IP(EA), eV:	-8.74(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]-1,3-dimethylthieno[2,3-c]pyrazole-5-carboxamide

Drug info:

PubChemData

Smile

COCCN1CCCC1CNC(=O)C2=CN=C3N(C2=O)CCS3

DOS

IR

Vibrations