Geometry & MOs

Info

ID:	157529
PubChem CID:	56435545
Reduced:	SN4O7C18H24 (1)
Stoich.:	AB4C7D18E24 (1)
Weight, g/mol:	446.108248
ΔH_f, kcal/mol:	-203.59
Dipole, Da:	3.85
IP(EA), eV:	-9.73(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylsulfonyl)-N-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]benzamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=C(O1)S(=O)(=O)N2CCCC2C(=O)NCCCC3=NC(=NO3)C

DOS

IR

Vibrations