Geometry & MOs

Info

ID:	55156
PubChem CID:	17389833
Reduced:	NO2C10H15 (1)
Stoich.:	AB2C10D15 (1)
Weight, g/mol:	209.105193
ΔH_f, kcal/mol:	-75.83
Dipole, Da:	3.32
IP(EA), eV:	-9.37(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(2-formylpyrrol-1-yl)-4-methylpentanoic acid

Drug info:

PubChemData

Smile

CCC(C)[C@@H](C(=O)O)N1C=CC=C1

DOS

IR

Vibrations