Geometry & MOs

Info

ID:	203815
PubChem CID:	79873779
Reduced:	N2O5C10H12 (1)
Stoich.:	A2B5C10D12 (1)
Weight, g/mol:	313.109627
ΔH_f, kcal/mol:	-209.98
Dipole, Da:	7.02
IP(EA), eV:	-10.24(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-1-(2-methyl-5-nitrophenyl)sulfonylpiperidin-4-amine

Drug info:

PubChemData

Smile

C1COCC1CN2C=C(C(=O)NC2=O)C(=O)O

DOS

IR

Vibrations