Geometry & MOs

Info

ID:	329423
PubChem CID:	126736548
Reduced:	O2C12H15 (2)
Stoich.:	A2B12C15 (2)
Weight, g/mol:	397.236542
ΔH_f, kcal/mol:	-182.34
Dipole, Da:	4.46
IP(EA), eV:	-9.54(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[8-[2-(tert-butylamino)-2-oxoethyl]-8-azabicyclo[3.2.1]octan-3-yl]methyl]-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=C(C=C1)C2=CC(=C(C=C2)C(C)(C)C)CC(=O)O)CC(=O)O

DOS

IR

Vibrations