Geometry & MOs

Info

ID:	48903
PubChem CID:	11528456
Reduced:	ClNO3C6H12 (1)
Stoich.:	ABC3D6E12 (1)
Weight, g/mol:	181.029442
ΔH_f, kcal/mol:	-175.5
Dipole, Da:	5.5
IP(EA), eV:	-9.56(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloro-2,3-dihydroindole-1-carbaldehyde

Drug info:

PubChemData

Smile

C1C[C@@H]([C@H](NC1)C(=O)O)O.Cl

DOS

IR

Vibrations