Geometry & MOs

Info

ID:	237340
PubChem CID:	92718760
Reduced:	NO2C8H8 (2)
Stoich.:	AB2C8D8 (2)
Weight, g/mol:	298.131742
ΔH_f, kcal/mol:	-39.63
Dipole, Da:	5.99
IP(EA), eV:	-8.82(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(R)-amino-(3,4-dimethoxyphenyl)methyl]-1,3-dihydroindol-2-one

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)[N+](=O)[O-])[C@@H]([C@@H]2COC3=CC=CC=C3O2)N

DOS

IR

Vibrations