Geometry & MOs

Info

ID:	169769
PubChem CID:	75144784
Reduced:	O4C17H22 (1)
Stoich.:	A4B17C22 (1)
Weight, g/mol:	201.086189
ΔH_f, kcal/mol:	-159.71
Dipole, Da:	7.51
IP(EA), eV:	-9.24(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N'-nitro-2-oxopiperidine-1-carboximidamide

Drug info:

PubChemData

Smile

CC(=CCCC(=CCC1=C(C(=CC(=C1)C(=O)O)O)O)C)C

DOS

IR

Vibrations