Geometry & MOs

Info

ID:	162918
PubChem CID:	57580825
Reduced:	O3N5H29C30 (1)
Stoich.:	A3B5C29D30 (1)
Weight, g/mol:	513.248838
ΔH_f, kcal/mol:	-24.6
Dipole, Da:	8.75
IP(EA), eV:	-8.36(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzoyl]piperazin-1-yl]-N-propan-2-ylacetamide

Drug info:

PubChemData

Smile

CC(C1CCN(C1)C(=O)C2=CC=C(C=C2)NC3=CC=C(N4C3=NC=C4)C5=CC6=C(C=C5)C(=O)NC6)C(=O)C

DOS

IR

Vibrations