Geometry & MOs

Info

ID:	312858
PubChem CID:	126609258
Reduced:	N3O4H25C26 (1)
Stoich.:	A3B4C25D26 (1)
Weight, g/mol:	294.136828
ΔH_f, kcal/mol:	-26.62
Dipole, Da:	3.88
IP(EA), eV:	-8.5(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dihydroindol-1-yl-[2-(ethylideneamino)-4-hydroxy-5-methylphenyl]methanone

Drug info:

PubChemData

Smile

CCC1=CC(=CC(=C1)[N+](=O)[O-])COC2=CC3=C(C=C2C)C(=O)N4[C@@H](CC5=CC=CC=C54)CN3

DOS

IR

Vibrations