Geometry & MOs

Info

ID:	431620
PubChem CID:	135171708
Reduced:	N2O3C22H36 (1)
Stoich.:	A2B3C22D36 (1)
Weight, g/mol:	477.283886
ΔH_f, kcal/mol:	-152.01
Dipole, Da:	3.21
IP(EA), eV:	-8.21(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-[4-(4-methoxy-4-oxobutan-2-yl)-N-(2-methylpropyl)-2-nitroanilino]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

C[C@H](CC(=O)OC)C1=CC(=C(C=C1)N(CC(C)C)C2CCC(CC2)OC)N

DOS

IR

Vibrations