Geometry & MOs

Info

ID:	133250
PubChem CID:	51497857
Reduced:	NO4C18H25 (1)
Stoich.:	AB4C18D25 (1)
Weight, g/mol:	348.183778
ΔH_f, kcal/mol:	-176.74
Dipole, Da:	1.13
IP(EA), eV:	-8.88(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-1-(2,3-dihydro-1H-inden-5-yl)ethyl]-3-(3-oxo-1H-isoindol-2-yl)propanamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1OC)C)C(=O)CCC(=O)N[C@H]2CCCOC2

DOS

IR

Vibrations