Geometry & MOs

Info

ID:	306243
PubChem CID:	125003308
Reduced:	O3N4C17H20 (1)
Stoich.:	A3B4C17D20 (1)
Weight, g/mol:	415.180839
ΔH_f, kcal/mol:	-71.15
Dipole, Da:	6.35
IP(EA), eV:	-9.79(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-fluoropyridin-2-yl)-6-[(2R)-4-(quinolin-6-ylmethyl)morpholin-2-yl]pyridin-3-amine

Drug info:

PubChemData

Smile

CC1=C(C=CC=N1)C(=O)N2CCO[C@@H](C2)CCC3=CC(=O)N=CN3

DOS

IR

Vibrations