Geometry & MOs

Info

ID:	343113
PubChem CID:	127266286
Reduced:	SN4O5C13H16 (1)
Stoich.:	AB4C5D13E16 (1)
Weight, g/mol:	321.114713
ΔH_f, kcal/mol:	-157.6
Dipole, Da:	8.77
IP(EA), eV:	-8.7(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3-hydroxyprop-1-enyl)phenyl]-1-propan-2-ylimidazole-4-sulfonamide

Drug info:

PubChemData

Smile

CC(C)N1C=C(N=C1)S(=O)(=O)NC2=CC=C(NC2=O)C(=O)OC

DOS

IR

Vibrations