Geometry & MOs

Info

ID:	158217
PubChem CID:	56463174
Reduced:	SN4O5C21H24 (1)
Stoich.:	AB4C5D21E24 (1)
Weight, g/mol:	387.198048
ΔH_f, kcal/mol:	-140.8
Dipole, Da:	4.48
IP(EA), eV:	-9.58(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-[4-methyl-2-(2-methylpropyl)-1,3-thiazol-5-yl]methanone

Drug info:

PubChemData

Smile

C1CC(=O)N(C1)CCC(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CC=C3

DOS

IR

Vibrations