Geometry & MOs

Info

ID:	420362
PubChem CID:	135112725
Reduced:	FNO3C23H26 (1)
Stoich.:	ABC3D23E26 (1)
Weight, g/mol:	289.109423
ΔH_f, kcal/mol:	-154.87
Dipole, Da:	1.85
IP(EA), eV:	-9.41(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(5-chloro-2-methylpyrimidin-4-yl)-3-cyclopropyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine

Drug info:

PubChemData

Smile

CC1(CCOC2(C1)CCN(CC2)C(=O)C3=CC=CC(=C3)C4=CC(=CC=C4)F)O

DOS

IR

Vibrations