Geometry & MOs

Info

ID:	290724
PubChem CID:	109841613
Reduced:	ION4C25H43 (1)
Stoich.:	ABC4D25E43 (1)
Weight, g/mol:	576.09351
ΔH_f, kcal/mol:	-62.58
Dipole, Da:	3.67
IP(EA), eV:	-8.89(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl]-2-methyl-3-[(4-propan-2-yl-1,3-thiazol-2-yl)methyl]guanidine;hydroiodide

Drug info:

PubChemData

Smile

CCNC(=NCC1=CC=C(C=C1)CN2CCC(CC2)O)NC3CCC(CC3)C(C)C.I

DOS

IR

Vibrations