Geometry & MOs

Info

ID:	217632
PubChem CID:	85088135
Reduced:	NO6C21H21 (1)
Stoich.:	AB6C21D21 (1)
Weight, g/mol:	383.209658
ΔH_f, kcal/mol:	-198.65
Dipole, Da:	6.05
IP(EA), eV:	-9.16(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl) 2-(1,3-dioxoisoindol-2-yl)pentanoate

Drug info:

PubChemData

Smile

COC(=O)C1=CC=CC(=C1)C(=O)NC2=CC=CC(=C2)CCC3C(C(=O)O3)CO

DOS

IR

Vibrations