Geometry & MOs

Info

ID:	276917
PubChem CID:	103825769
Reduced:	N5C16H19 (1)
Stoich.:	A5B16C19 (1)
Weight, g/mol:	256.112425
ΔH_f, kcal/mol:	102.79
Dipole, Da:	2.23
IP(EA), eV:	-7.98(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-fluoro-N-[(1-methylbenzimidazol-2-yl)methyl]pyridin-3-amine

Drug info:

PubChemData

Smile

CC(C)N1C=C(C=N1)CNC2=CC=CC=C2N3C=CC=N3

DOS

IR

Vibrations