Geometry & MOs

Info

ID:	305943
PubChem CID:	124975202
Reduced:	FO2N6C24H27 (1)
Stoich.:	AB2C6D24E27 (1)
Weight, g/mol:	311.17461
ΔH_f, kcal/mol:	-14.85
Dipole, Da:	2.01
IP(EA), eV:	-9.02(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2S)-2-[2-[(3-methylpyridin-2-yl)amino]pyridin-4-yl]pyrrolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

CN1CC[C@H](C1)N2C=C(C=N2)C(=O)N3CCC(CC3)C4=NC=CN=C4OC5=CC=C(C=C5)F

DOS

IR

Vibrations