Geometry & MOs

Info

ID:	237327
PubChem CID:	92718473
Reduced:	NOH19C20 (1)
Stoich.:	ABC19D20 (1)
Weight, g/mol:	297.100108
ΔH_f, kcal/mol:	20.85
Dipole, Da:	0.94
IP(EA), eV:	-8.16(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-(2-hydroxy-4-methylbenzoyl)-2,3-dihydroindole-2-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N[C@@H](C2=CC=CC=C2)C3=CC=C(C=C3)O

DOS

IR

Vibrations