Geometry & MOs

Info

ID:	29071
PubChem CID:	831430
Reduced:	N2O2H5C8 (2)
Stoich.:	A2B2C5D8 (2)
Weight, g/mol:	257.177964
ΔH_f, kcal/mol:	18.03
Dipole, Da:	4.9
IP(EA), eV:	-8.83(-2.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R,2S,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]benzamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C#N)NCN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

DOS

IR

Vibrations