Geometry & MOs

Info

ID:	317574
PubChem CID:	126643615
Reduced:	NO2C4H7 (2)
Stoich.:	AB2C4D7 (2)
Weight, g/mol:	511.29452
ΔH_f, kcal/mol:	-169.1
Dipole, Da:	8.97
IP(EA), eV:	-9.88(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[3-[bicyclo[2.2.1]heptane-2-carbonyl-[deuterio-[4-[4-(dimethylamino)phenyl]phenyl]methyl]amino]phenyl]propanoate

Drug info:

PubChemData

Smile

CN(C)C(=O)OCC1CCN1C(=O)O

DOS

IR

Vibrations