Geometry & MOs

Info

ID:	283695
PubChem CID:	103998990
Reduced:	ON2C16H22 (1)
Stoich.:	AB2C16D22 (1)
Weight, g/mol:	286.204513
ΔH_f, kcal/mol:	-32.15
Dipole, Da:	3.01
IP(EA), eV:	-9.28(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-methylcyclohexyl)ethyl]-2,3-dihydro-1H-isoindole-5-carboxamide

Drug info:

PubChemData

Smile

CC1CCCCCN1C(=O)C2=CC3=C(CNC3)C=C2

DOS

IR

Vibrations