Geometry & MOs

Info

ID:	274389
PubChem CID:	103808977
Reduced:	N2O2C17H26 (1)
Stoich.:	A2B2C17D26 (1)
Weight, g/mol:	277.142641
ΔH_f, kcal/mol:	-94.35
Dipole, Da:	3.98
IP(EA), eV:	-8.78(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-methyl-N-[(2-nitrophenyl)methyl]piperidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)OC1=CC=CC(=C1)C(C)NC(=O)[C@@H]2CCCCN2

DOS

IR

Vibrations