Geometry & MOs

Info

ID:	130197
PubChem CID:	51075229
Reduced:	OSN6C14H18 (1)
Stoich.:	ABC6D14E18 (1)
Weight, g/mol:	282.151433
ΔH_f, kcal/mol:	35.27
Dipole, Da:	3.59
IP(EA), eV:	-8.88(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-methylbutan-2-yl)-4-(1,3-thiazol-2-yl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CSC(=N1)CNC(=O)N2CCN(CC2)C3=NC=CN=C3

DOS

IR

Vibrations