Geometry & MOs

Info

ID:	292033
PubChem CID:	114147884
Reduced:	ClNO2F3C12H19 (1)
Stoich.:	ABC2D3E12F19 (1)
Weight, g/mol:	252.158626
ΔH_f, kcal/mol:	-294.21
Dipole, Da:	3.85
IP(EA), eV:	-9.88(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-hydroxypentyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide

Drug info:

PubChemData

Smile

C1CC(CCC1CNC(=O)CCOCC(F)(F)F)Cl

DOS

IR

Vibrations