Geometry & MOs

Info

ID:	307704
PubChem CID:	125308257
Reduced:	N2O7C24H24 (1)
Stoich.:	A2B7C24D24 (1)
Weight, g/mol:	369.088019
ΔH_f, kcal/mol:	-223.73
Dipole, Da:	1.65
IP(EA), eV:	-9.06(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-[(2-chlorophenyl)methoxy]-4-oxo-N-(pyridin-4-ylmethyl)-3H-pyridine-6-carboxamide

Drug info:

PubChemData

Smile

C[C@@H]1CC(=O)OC2=C1C=CC(=C2C)OCC(=O)N[C@@H](CC3=C4C=C(C=CC4=NC3)O)C(=O)O

DOS

IR

Vibrations