Geometry & MOs

Info

ID:	146115
PubChem CID:	53637988
Reduced:	N2O3C23H32 (1)
Stoich.:	A2B3C23D32 (1)
Weight, g/mol:	297.096085
ΔH_f, kcal/mol:	-71.04
Dipole, Da:	5.8
IP(EA), eV:	-8.91(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-6-(2,4-dinitrophenyl)hexanoic acid

Drug info:

PubChemData

Smile

CCCC1=NOC(=C1)CCCCCCCCOC2=CC=C(C=C2)C3=NCCO3

DOS

IR

Vibrations