Geometry & MOs

Info

ID:	283696
PubChem CID:	103998994
Reduced:	ON2C18H26 (1)
Stoich.:	AB2C18D26 (1)
Weight, g/mol:	292.043712
ΔH_f, kcal/mol:	-48.48
Dipole, Da:	3.5
IP(EA), eV:	-9.36(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-chlorothiophen-2-yl)methyl]-2,3-dihydro-1H-isoindole-5-carboxamide

Drug info:

PubChemData

Smile

CC1CCC(CC1)CCNC(=O)C2=CC3=C(CNC3)C=C2

DOS

IR

Vibrations