Geometry & MOs

Info

ID:	62726
PubChem CID:	26736356
Reduced:	N2O5C28H30 (1)
Stoich.:	A2B5C28D30 (1)
Weight, g/mol:	462.157306
ΔH_f, kcal/mol:	-139.33
Dipole, Da:	7.82
IP(EA), eV:	-8.32(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-ethoxyphenyl)-1-[4-(methylamino)-3-nitrophenyl]sulfonylpiperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1NC(=O)[C@@H]2CCC(=O)N([C@H]2C3=CC=CC=C3OC)C4=CC=C(C=C4)OC

DOS

IR

Vibrations