Geometry & MOs

Info

ID:	145393
PubChem CID:	53515426
Reduced:	F2O2N3H13C15 (1)
Stoich.:	A2B2C3D13E15 (1)
Weight, g/mol:	338.163043
ΔH_f, kcal/mol:	-95.65
Dipole, Da:	3.51
IP(EA), eV:	-9.56(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2,3-dihydroindol-1-ylmethyl)phenyl]-1,4-dioxane-2-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC=CO1)NC(=O)CN2C=NC3=CC(=C(C=C32)F)F

DOS

IR

Vibrations