Geometry & MOs

Info

ID:	362531
PubChem CID:	127308146
Reduced:	O2N4C19H26 (1)
Stoich.:	A2B4C19D26 (1)
Weight, g/mol:	371.141596
ΔH_f, kcal/mol:	-50.62
Dipole, Da:	5.42
IP(EA), eV:	-8.69(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-methoxy-1,3-benzothiazol-2-yl)-3-(4-methylpyrazol-1-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)NC(=O)N2CCOC(C2)CN3C(=CC(=N3)C)C

DOS

IR

Vibrations