Geometry & MOs

Info

ID:	158375
PubChem CID:	56463534
Reduced:	N2S2O5C19H30 (1)
Stoich.:	A2B2C5D19E30 (1)
Weight, g/mol:	459.024489
ΔH_f, kcal/mol:	-212.87
Dipole, Da:	7.5
IP(EA), eV:	-9.5(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2,4-dichlorophenyl)methyl]-N-(2-ethylsulfonylethyl)-3-methylthieno[2,3-c]pyrazole-5-carboxamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)CCNC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2

DOS

IR

Vibrations