Geometry & MOs

Info

ID:	320713
PubChem CID:	126662991
Reduced:	NO2C18H29 (1)
Stoich.:	AB2C18D29 (1)
Weight, g/mol:	235.112777
ΔH_f, kcal/mol:	-84.27
Dipole, Da:	2.08
IP(EA), eV:	-8.31(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chloropropyl)-3,3-dimethyl-2-methylideneindole

Drug info:

PubChemData

Smile

C[C@@H]1C(=CC=C1O)C2=CCC(CC2)CNCCCCCO

DOS

IR

Vibrations