Geometry & MOs

Info

ID:	130161
PubChem CID:	51075106
Reduced:	SN4C16H16 (1)
Stoich.:	AB4C16D16 (1)
Weight, g/mol:	334.055818
ΔH_f, kcal/mol:	105.96
Dipole, Da:	3.91
IP(EA), eV:	-8.79(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]thiophene-2-sulfonamide

Drug info:

PubChemData

Smile

CC1=NC2=CC=CC=C2N=C1CSC3=NC=CN3C4CC4

DOS

IR

Vibrations