Geometry & MOs

Info

ID:	155010
PubChem CID:	56314576
Reduced:	SO2N6C26H34 (1)
Stoich.:	AB2C6D26E34 (1)
Weight, g/mol:	350.083747
ΔH_f, kcal/mol:	1.99
Dipole, Da:	7.2
IP(EA), eV:	-8.74(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(furan-3-ylmethyl)-2-(1-phenylpyrazol-4-yl)-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1CCN(CC1)C(=O)C2=CSC(=N2)C3=CN(N=C3)C4=CC=CC=C4)CN(C)C

DOS

IR

Vibrations