Geometry & MOs

Info

ID:	149092
PubChem CID:	53788763
Reduced:	NO4C11H13 (1)
Stoich.:	AB4C11D13 (1)
Weight, g/mol:	541.280138
ΔH_f, kcal/mol:	-145.48
Dipole, Da:	1.77
IP(EA), eV:	-9.32(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-[2-[2-formyl-4-[3-(propan-2-ylamino)pyridin-2-yl]piperazin-1-yl]-1H-indol-5-yl]-2-phenylmethoxyacetamide

Drug info:

PubChemData

Smile

COCCOC(=O)C1=CC=CC=C1NC=O

DOS

IR

Vibrations