Geometry & MOs

Info

ID:	129702
PubChem CID:	51073602
Reduced:	SO2N7H13C14 (1)
Stoich.:	AB2C7D13E14 (1)
Weight, g/mol:	317.156184
ΔH_f, kcal/mol:	49.97
Dipole, Da:	6.16
IP(EA), eV:	-9.57(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[4-[(2-methoxy-5-methylphenyl)methyl]piperazin-1-yl]methyl]-1,3-thiazole

Drug info:

PubChemData

Smile

CC(=O)NC1=NC(=CS1)CN2N=C(N=N2)C3=CC=C(C=C3)C(=O)N

DOS

IR

Vibrations