Geometry & MOs

Info

ID:	320573
PubChem CID:	126661857
Reduced:	NSCl2O2H7C10 (1)
Stoich.:	ABC2D2E7F10 (1)
Weight, g/mol:	194.153147
ΔH_f, kcal/mol:	-41.3
Dipole, Da:	6.85
IP(EA), eV:	-9.88(-1.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-4-piperazin-1-yl-1,2-dihydropyridin-3-amine

Drug info:

PubChemData

Smile

CC1=C(C2=C(C=NC=C2C=C1)Cl)S(=O)(=O)Cl

DOS

IR

Vibrations