Geometry & MOs

Info

ID:	172193
PubChem CID:	75477160
Reduced:	SO2N3C15H19 (1)
Stoich.:	AB2C3D15E19 (1)
Weight, g/mol:	312.104482
ΔH_f, kcal/mol:	-50.15
Dipole, Da:	2.69
IP(EA), eV:	-8.74(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-benzyl-1,3-thiazol-2-yl)-3-pyrazol-1-ylpropanamide

Drug info:

PubChemData

Smile

CCC(CO)NC(=O)NC1=C(N=C(S1)C2=CC=CC=C2)C

DOS

IR

Vibrations