Geometry & MOs

Info

ID:	283684
PubChem CID:	103998554
Reduced:	N2O3C13H16 (1)
Stoich.:	A2B3C13D16 (1)
Weight, g/mol:	272.188863
ΔH_f, kcal/mol:	-98.16
Dipole, Da:	3.58
IP(EA), eV:	-9.31(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclohexylmethyl)-N-methyl-2,3-dihydro-1H-isoindole-5-carboxamide

Drug info:

PubChemData

Smile

CN(CC(=O)OC)C(=O)C1=CC2=C(CNC2)C=C1

DOS

IR

Vibrations