Geometry & MOs

Info

ID:	375006
PubChem CID:	131465136
Reduced:	NO2C12H17 (1)
Stoich.:	AB2C12D17 (1)
Weight, g/mol:	186.079313
ΔH_f, kcal/mol:	-51.0
Dipole, Da:	1.7
IP(EA), eV:	-10.12(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-2-(7-methyl-1H-indol-3-yl)acetonitrile

Drug info:

PubChemData

Smile

CC1=C(ON=C1C2CCCCC2)C(=O)C

DOS

IR

Vibrations