Geometry & MOs

Info

ID:	247552
PubChem CID:	103072203
Reduced:	ClN2O2C15H17 (1)
Stoich.:	AB2C2D15E17 (1)
Weight, g/mol:	286.168128
ΔH_f, kcal/mol:	-37.11
Dipole, Da:	5.52
IP(EA), eV:	-9.16(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethyl-1-[2-[(propan-2-ylamino)methyl]prop-2-enyl]indole-2,3-dione

Drug info:

PubChemData

Smile

CCCNCC(=C)CN1C2=C(C(=CC=C2)Cl)C(=O)C1=O

DOS

IR

Vibrations