Geometry & MOs

Info

ID:	314722
PubChem CID:	126622861
Reduced:	FO2N3C15H22 (1)
Stoich.:	AB2C3D15E22 (1)
Weight, g/mol:	517.21139
ΔH_f, kcal/mol:	-125.32
Dipole, Da:	2.27
IP(EA), eV:	-8.88(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-[2-(3-acetyl-5-naphthalen-2-ylindazol-1-yl)acetyl]-N-(6-methylpyridin-2-yl)azetidine-2-carboxamide

Drug info:

PubChemData

Smile

CCCCCOC1=CC=CC(=N1)NC(=O)[C@@H]2C[C@H](CN2)F

DOS

IR

Vibrations