Geometry & MOs

Info

ID:	355937
PubChem CID:	127290789
Reduced:	O2N3C14H15 (1)
Stoich.:	A2B3C14D15 (1)
Weight, g/mol:	246.136828
ΔH_f, kcal/mol:	-20.34
Dipole, Da:	4.24
IP(EA), eV:	-8.88(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(oxan-3-yl)-2,3-dihydroindole-1-carboxamide

Drug info:

PubChemData

Smile

C1CN(C2=CC=CC=C21)C(=O)N3CCOC(C3)C#N

DOS

IR

Vibrations