Geometry & MOs

Info

ID:	58403
PubChem CID:	24698218
Reduced:	BrNO3H12C15 (1)
Stoich.:	ABC3D12E15 (1)
Weight, g/mol:	252.220164
ΔH_f, kcal/mol:	-80.57
Dipole, Da:	6.13
IP(EA), eV:	-9.31(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-3-methylpentanamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)Br)C(=O)NC2=CC=C(C=C2)CC(=O)O

DOS

IR

Vibrations