Geometry & MOs

Info

ID:	244480
PubChem CID:	99355670
Reduced:	ClOSN3H14C19 (1)
Stoich.:	ABCD3E14F19 (1)
Weight, g/mol:	350.185509
ΔH_f, kcal/mol:	61.37
Dipole, Da:	5.81
IP(EA), eV:	-9.08(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(8-methylimidazo[1,2-a]pyridin-2-yl)-N-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]acetamide

Drug info:

PubChemData

Smile

C1=CN2C=CN=C2C(=C1)C(=O)N[C@H](C3=CC=C(C=C3)Cl)C4=CC=CS4

DOS

IR

Vibrations