Geometry & MOs

Info

ID:	131379
PubChem CID:	51198987
Reduced:	SO2N4H16C17 (1)
Stoich.:	AB2C4D16E17 (1)
Weight, g/mol:	361.065176
ΔH_f, kcal/mol:	12.26
Dipole, Da:	3.92
IP(EA), eV:	-8.93(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chlorophenoxy)-N-[2-(thiophen-3-ylmethyl)pyrazol-3-yl]propanamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=CC(=C1)C(=O)NC2=CC=NN2CC3=CSC=C3

DOS

IR

Vibrations