Geometry & MOs

Info

ID:	178168
PubChem CID:	76289388
Reduced:	SN4O4C26H34 (1)
Stoich.:	AB4C4D26E34 (1)
Weight, g/mol:	414.245333
ΔH_f, kcal/mol:	-113.46
Dipole, Da:	5.82
IP(EA), eV:	-8.82(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,4-dimethyl-N-[5-(5-phenylpyrazolidin-3-yl)pentyl]-2-propan-2-yl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC(C)N1C(=O)C2=C(S1(=O)=O)C=C(C=C2)C(=O)N(C)CCCCCC3CC(NN3)C4=CC=CC=C4

DOS

IR

Vibrations