Geometry & MOs

Info

ID:	332131
PubChem CID:	127250417
Reduced:	O2N5C25H29 (1)
Stoich.:	A2B5C25D29 (1)
Weight, g/mol:	431.212139
ΔH_f, kcal/mol:	22.94
Dipole, Da:	3.37
IP(EA), eV:	-7.9(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[6-[4-[(1-ethyl-6-fluoroindol-3-yl)methyl]morpholin-2-yl]pyridin-3-yl]pyridin-2-amine

Drug info:

PubChemData

Smile

CC(C)N1C=C(C2=C1C=CC(=C2)OC)CN3CCOC(C3)C4=NC=C(C=C4)C5=CC=NN5

DOS

IR

Vibrations