Geometry & MOs

Info

ID:	324950
PubChem CID:	126678896
Reduced:	ClO3N6C17H19 (1)
Stoich.:	AB3C6D17E19 (1)
Weight, g/mol:	198.184447
ΔH_f, kcal/mol:	-19.51
Dipole, Da:	8.55
IP(EA), eV:	-8.96(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-1-(1-propan-2-ylpiperidin-4-yl)guanidine

Drug info:

PubChemData

Smile

CCN(CCO)C(=O)C1=CC(=C(C=C1)Cl)COC2=CC(=NC3=NNN=C23)N

DOS

IR

Vibrations