Geometry & MOs

Info

ID:	439256
PubChem CID:	135229023
Reduced:	O2N4C19H26 (1)
Stoich.:	A2B4C19D26 (1)
Weight, g/mol:	552.212118
ΔH_f, kcal/mol:	-41.75
Dipole, Da:	5.68
IP(EA), eV:	-8.81(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-N-[4-[[4-[[2-(4-methylphenyl)-5-oxo-1H-pyrazol-3-yl]carbamoylamino]naphthalen-1-yl]oxymethyl]pyridin-2-yl]acetamide

Drug info:

PubChemData

Smile

CCCCCCNC1=NC(=NC=C1OCC2=CC=CC=C2)NC(=O)C

DOS

IR

Vibrations