Geometry & MOs

Info

ID:	78278
PubChem CID:	49684255
Reduced:	SN3O4C23H33 (1)
Stoich.:	AB3C4D23E33 (1)
Weight, g/mol:	353.123169
ΔH_f, kcal/mol:	-158.39
Dipole, Da:	5.88
IP(EA), eV:	-8.56(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-[(1-methylpyrrol-2-yl)methyl]piperidin-4-yl]methyl]thiophene-2-sulfonamide

Drug info:

PubChemData

Smile

CCC(=O)NC1=CC(=C(C=C1)S(=O)(=O)NCC2CCN(CC2)CC3=C(OC(=C3)C)C)C

DOS

IR

Vibrations