Geometry & MOs

Info

ID:	43055
PubChem CID:	10318218
Reduced:	N2O3C9H11 (2)
Stoich.:	A2B3C9D11 (2)
Weight, g/mol:	390.194343
ΔH_f, kcal/mol:	-218.23
Dipole, Da:	8.49
IP(EA), eV:	-8.71(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4-[4-(methylamino)phenyl]-6-phenylpyridin-2-yl]oxyhexanoic acid

Drug info:

PubChemData

Smile

CN1C(=O)C(=O)/C(=C(\O)/NCCCCN/C(=C\2/C(=O)C(=O)N(C=C2)C)/O)/C=C1

DOS

IR

Vibrations