Geometry & MOs

Info

ID:	343340
PubChem CID:	127266513
Reduced:	N2O3C20H26 (1)
Stoich.:	A2B3C20D26 (1)
Weight, g/mol:	348.125612
ΔH_f, kcal/mol:	-97.85
Dipole, Da:	1.66
IP(EA), eV:	-9.3(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-cyano-1-methylpyrazol-3-yl)-4-pentoxybenzenesulfonamide

Drug info:

PubChemData

Smile

CC1CN(CCO1)C(=O)C2=CC=CC(=C2)CNC(=O)C=CC3CCC3

DOS

IR

Vibrations