Geometry & MOs

Info

ID:	372044
PubChem CID:	131289957
Reduced:	ON3C11H17 (1)
Stoich.:	AB3C11D17 (1)
Weight, g/mol:	233.071975
ΔH_f, kcal/mol:	-8.41
Dipole, Da:	1.65
IP(EA), eV:	-9.14(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-3-(3-chloro-1-methylindol-5-yl)propanenitrile

Drug info:

PubChemData

Smile

C1CN(C[C@@H](N1)CO)CC2=CC=NC=C2

DOS

IR

Vibrations