Geometry & MOs

Info

ID:	73695
PubChem CID:	48420030
Reduced:	N3O3C15H17 (1)
Stoich.:	A3B3C15D17 (1)
Weight, g/mol:	321.111341
ΔH_f, kcal/mol:	-104.46
Dipole, Da:	9.17
IP(EA), eV:	-9.38(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-dioxoisoindol-5-yl)-3,4-dihydro-1H-isoquinoline-2-carboxamide

Drug info:

PubChemData

Smile

C1CCCN(CC1)C(=O)NC2=CC3=C(C=C2)C(=O)NC3=O

DOS

IR

Vibrations