Geometry & MOs

Info

ID:	208602
PubChem CID:	80550979
Reduced:	FO2N3C6H8 (1)
Stoich.:	AB2C3D6E8 (1)
Weight, g/mol:	213.220498
ΔH_f, kcal/mol:	-103.81
Dipole, Da:	7.67
IP(EA), eV:	-9.62(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,2-dimethyl-2-piperazin-1-yl-N-propan-2-ylpropan-1-amine

Drug info:

PubChemData

Smile

CNCC1=NC(=C(C(=O)N1)F)O

DOS

IR

Vibrations