Geometry & MOs

Info

ID:	254851
PubChem CID:	103128162
Reduced:	FN5C14H14 (1)
Stoich.:	AB5C14D14 (1)
Weight, g/mol:	256.112425
ΔH_f, kcal/mol:	63.87
Dipole, Da:	3.71
IP(EA), eV:	-9.28(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-fluoropyridin-4-yl)-(1-methylindazol-3-yl)methanamine

Drug info:

PubChemData

Smile

CCNC(C1=C(C=NC=C1)F)C2=C3C=NC=CN3N=C2

DOS

IR

Vibrations